N-(4-acetamidophenyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-benzamide

Systemtic Name: N-(4-acetamidophenyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-benzamide Openeye Name: N-(4-acetamidophenyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-benzamide CAS Name: N-(4-acetamidophenyl)-3-(1-azepanylsulfonyl)-4-methoxybenzamide IUPAC Name: N-(4-acetamidophenyl)-3-(azepan-1-ylsulfonyl)-4-methoxybenzamide Traditional Name: N-(4-acetamidophenyl)-3-(azepan-1-ylsulfonyl)-4-methoxy-benzamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H27N3O5S/c1-16(26)23-18-8-10-19(11-9-18)24-22(27)17-7-12-20(30-2)21(15-17)31(28,29)25-13-5-3-4-6-14-25/h7-12,15H,3-6,13-14H2,1-2H3,(H,23,26)(H,24,27)