3-(azepan-1-ylsulfonyl)-N-cyclopropyl-4-methoxy-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-cyclopropyl-4-methoxy-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-cyclopropyl-4-methoxy-N-(p-tolylmethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-cyclopropyl-4-methoxy-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-cyclopropyl-4-methoxy-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-cyclopropyl-4-methoxy-N-(4-methylbenzyl)benzamide Formula: C25H32N2O4S MolecularWeight: 456.59758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CC2)C(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CC2)C(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H32N2O4S/c1-19-7-9-20(10-8-19)18-27(22-12-13-22)25(28)21-11-14-23(31-2)24(17-21)32(29,30)26-15-5-3-4-6-16-26/h7-11,14,17,22H,3-6,12-13,15-16,18H2,1-2H3