3-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(3-pyridin-3-ylpropoxy)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(3-pyridin-3-ylpropoxy)phenyl]methyl]thiophene-2-carboxamide Openeye Name: 3-methyl-N-[(3S)-2-oxoazepan-3-yl]-N-[[4-[3-(3-pyridyl)propoxy]phenyl]methyl]thiophene-2-carboxamide CAS Name: 3-methyl-N-[(3S)-2-oxo-3-azepanyl]-N-[[4-[3-(3-pyridinyl)propoxy]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 3-methyl-N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(3-pyridin-3-ylpropoxy)phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-3-methyl-N-[4-[3-(3-pyridyl)propoxy]benzyl]thiophene-2-carboxamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N(CC2=CC=C(C=C2)OCCCC3=CN=CC=C3)C4CCCCNC4=O

Isomeric SMILES

CC1=C(SC=C1)C(=O)N(CC2=CC=C(C=C2)OCCCC3=CN=CC=C3)[C@H]4CCCCNC4=O

InChI

InChI=1S/C27H31N3O3S/c1-20-13-17-34-25(20)27(32)30(24-8-2-3-15-29-26(24)31)19-22-9-11-23(12-10-22)33-16-5-7-21-6-4-14-28-18-21/h4,6,9-14,17-18,24H,2-3,5,7-8,15-16,19H2,1H3,(H,29,31)/t24-/m0/s1