N-[[3,5-dimethoxy-4-(2-thiophen-3-ylethoxy)phenyl]methyl]-2-methoxy-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide

Systemtic Name: N-[[3,5-dimethoxy-4-(2-thiophen-3-ylethoxy)phenyl]methyl]-2-methoxy-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide Openeye Name: N-[[3,5-dimethoxy-4-[2-(3-thienyl)ethoxy]phenyl]methyl]-2-methoxy-N-[(3S)-2-oxoazepan-3-yl]benzamide CAS Name: N-[[3,5-dimethoxy-4-[2-(3-thiophenyl)ethoxy]phenyl]methyl]-2-methoxy-N-[(3S)-2-oxo-3-azepanyl]benzamide IUPAC Name: N-[[3,5-dimethoxy-4-(2-thiophen-3-ylethoxy)phenyl]methyl]-2-methoxy-N-[(3S)-2-oxoazepan-3-yl]benzamide Traditional Name: N-[3,5-dimethoxy-4-[2-(3-thienyl)ethoxy]benzyl]-N-[(3S)-2-ketoazepan-3-yl]-2-methoxy-benzamide Formula: C29H34N2O6S MolecularWeight: 538.65506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)N(CC2=CC(=C(C(=C2)OC)OCCC3=CSC=C3)OC)C4CCCCNC4=O

Isomeric SMILES

COC1=CC=CC=C1C(=O)N(CC2=CC(=C(C(=C2)OC)OCCC3=CSC=C3)OC)[C@H]4CCCCNC4=O

InChI

InChI=1S/C29H34N2O6S/c1-34-24-10-5-4-8-22(24)29(33)31(23-9-6-7-13-30-28(23)32)18-21-16-25(35-2)27(26(17-21)36-3)37-14-11-20-12-15-38-19-20/h4-5,8,10,12,15-17,19,23H,6-7,9,11,13-14,18H2,1-3H3,(H,30,32)/t23-/m0/s1