1-(azepan-1-yl)-4-[4-(3-methoxythiophen-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-phenyl-butan-1-one hydrochloride

Systemtic Name: 1-(azepan-1-yl)-4-[4-(3-methoxythiophen-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-phenyl-butan-1-one hydrochloride Openeye Name: 1-(azepan-1-yl)-4-[4-(3-methoxy-2-thienyl)-3,6-dihydro-2H-pyridin-1-yl]-2-phenyl-butan-1-one hydrochloride CAS Name: 1-(1-azepanyl)-4-[4-(3-methoxy-2-thiophenyl)-3,6-dihydro-2H-pyridin-1-yl]-2-phenyl-1-butanone hydrochloride IUPAC Name: 1-(azepan-1-yl)-4-[4-(3-methoxythiophen-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-phenylbutan-1-one hydrochloride Traditional Name: 1-(azepan-1-yl)-4-[4-(3-methoxy-2-thienyl)-3,6-dihydro-2H-pyridin-1-yl]-2-phenyl-butan-1-one hydrochloride Formula: C26H35ClN2O2S MolecularWeight: 475.0863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC=C1)C2=CCN(CC2)CCC(C3=CC=CC=C3)C(=O)N4CCCCCC4.Cl

Isomeric SMILES

COC1=C(SC=C1)C2=CCN(CC2)CCC(C3=CC=CC=C3)C(=O)N4CCCCCC4.Cl

InChI

InChI=1S/C26H34N2O2S.ClH/c1-30-24-14-20-31-25(24)22-11-17-27(18-12-22)19-13-23(21-9-5-4-6-10-21)26(29)28-15-7-2-3-8-16-28;/h4-6,9-11,14,20,23H,2-3,7-8,12-13,15-19H2,1H3;1H