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Phenylbutylamines

Organic compounds that contain a phenyl ring with a butyl group bonded to an amino functional group.

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1

Ibutilide Fumarate, TRC

CAS: 122647-32-9 Molecular Formula: 2 C20 H36 N2 O3 S . C4 H4 O4 Molecular Weight (g/mol): 885.22 Synonym: Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (2E)-2-butenedioate (2:1),Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (2E)-2-butenedioate (2:1) (salt) (9CI),Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (±)-, (E)-2-butenedioate (2:1) (salt),Corvert,Ibutilide fumarate,Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (E)-2-butenedioate (2:1) (salt),U 70226E IUPAC Name: (E)-but-2-enedioic acid;N-[4-[4-[ethyl(heptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide SMILES: CCCCCCCN(CC)CCCC(O)c1ccc(NS(=O)(=O)C)cc1.CCCCCCCN(CC)CCCC(O)c2ccc(NS(=O)(=O)C)cc2.OC(=O)\C=C\C(=O)O

CAS 122647-32-9
Molecular Weight (g/mol) 885.22
SMILES CCCCCCCN(CC)CCCC(O)c1ccc(NS(=O)(=O)C)cc1.CCCCCCCN(CC)CCCC(O)c2ccc(NS(=O)(=O)C)cc2.OC(=O)\C=C\C(=O)O
Synonym Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (2E)-2-butenedioate (2:1),Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (2E)-2-butenedioate (2:1) (salt) (9CI),Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (±)-, (E)-2-butenedioate (2:1) (salt),Corvert,Ibutilide fumarate,Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (E)-2-butenedioate (2:1) (salt),U 70226E
IUPAC Name (E)-but-2-enedioic acid;N-[4-[4-[ethyl(heptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide
Molecular Formula 2 C20 H36 N2 O3 S . C4 H4 O4
2

rac Desfluoro Citalopram Oxalate, TRC

CAS: 1093072-86-6 Molecular Formula: C20 H22 N2 O . C2 H2 O4 Molecular Weight (g/mol): 396.44 Synonym: 1-(3-Dimethylaminopropyl)-1-(phenyl)-5-phthalan-carbonitrile Oxalate,1-[3-(Dimethylamino)propyl]-1,3-dihydro-1-phenyl-5-isobenzofurancarbonitrile Ethanedioate (1:1) IUPAC Name: 1-[3-(dimethylamino)propyl]-1-phenyl-3H-2-benzofuran-5-carbonitrile;oxalic acid SMILES: CN(C)CCCC1(OCc2cc(ccc12)C#N)c3ccccc3.OC(=O)C(=O)O

CAS 1093072-86-6
Molecular Weight (g/mol) 396.44
SMILES CN(C)CCCC1(OCc2cc(ccc12)C#N)c3ccccc3.OC(=O)C(=O)O
Synonym 1-(3-Dimethylaminopropyl)-1-(phenyl)-5-phthalan-carbonitrile Oxalate,1-[3-(Dimethylamino)propyl]-1,3-dihydro-1-phenyl-5-isobenzofurancarbonitrile Ethanedioate (1:1)
IUPAC Name 1-[3-(dimethylamino)propyl]-1-phenyl-3H-2-benzofuran-5-carbonitrile;oxalic acid
Molecular Formula C20 H22 N2 O . C2 H2 O4
3

Ibutilide hemifumarate salt, 99%, Thermo Scientific Chemicals

CAS: 122647-32-9 Molecular Formula: C44H76N4O10S2 Molecular Weight (g/mol): 885.23 MDL Number: MFCD01715410 InChI Key: PCIOHQNIRPWFMV-WXXKFALUNA-N Synonym: ibutilide fumarate,corvert,ibutilide fumarate usan,ibutilide hemifumarate,ibutilide hemifumarate salt,corvert tn,+--4'-4-ethylheptylamino-1-hydroxybutyl methanesulfoanilide e-2-butenedioate 2:1,+--4'-4-ethylheptylamino-1-hydroxybutyl methanesulfonanilide fumarate 2:1 salt,+--n-4-4-ethylheptylamino-1-hydroxybutyl phenyl methanesulfonamide e-butenedioate PubChem CID: 5281065 IUPAC Name: (E)-but-2-enedioic acid;N-[4-[4-[ethyl(heptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide SMILES: OC(=O)\C=C\C(O)=O.CCCCCCCN(CC)CCCC(O)C1=CC=C(NS(C)(=O)=O)C=C1.CCCCCCCN(CC)CCCC(O)C1=CC=C(NS(C)(=O)=O)C=C1

PubChem CID 5281065
CAS 122647-32-9
Molecular Weight (g/mol) 885.23
MDL Number MFCD01715410
SMILES OC(=O)\C=C\C(O)=O.CCCCCCCN(CC)CCCC(O)C1=CC=C(NS(C)(=O)=O)C=C1.CCCCCCCN(CC)CCCC(O)C1=CC=C(NS(C)(=O)=O)C=C1
Synonym ibutilide fumarate,corvert,ibutilide fumarate usan,ibutilide hemifumarate,ibutilide hemifumarate salt,corvert tn,+--4'-4-ethylheptylamino-1-hydroxybutyl methanesulfoanilide e-2-butenedioate 2:1,+--4'-4-ethylheptylamino-1-hydroxybutyl methanesulfonanilide fumarate 2:1 salt,+--n-4-4-ethylheptylamino-1-hydroxybutyl phenyl methanesulfonamide e-butenedioate
IUPAC Name (E)-but-2-enedioic acid;N-[4-[4-[ethyl(heptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide
InChI Key PCIOHQNIRPWFMV-WXXKFALUNA-N
Molecular Formula C44H76N4O10S2