3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-(phenylmethyl)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-(phenylmethyl)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2-benzylphenyl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-(phenylmethyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2-benzylphenyl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-benzylphenyl)-4-methoxy-benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CC3=CC=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CC3=CC=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H30N2O4S/c1-33-25-16-15-23(20-26(25)34(31,32)29-17-9-2-3-10-18-29)27(30)28-24-14-8-7-13-22(24)19-21-11-5-4-6-12-21/h4-8,11-16,20H,2-3,9-10,17-19H2,1H3,(H,28,30)