2-(4-acetamidophenyl)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]ethanamide

Systemtic Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]ethanamide Openeye Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]acetamide CAS Name: 2-(4-acetamidophenyl)-N-[3-(1-azepanylsulfonyl)-4-methylphenyl]acetamide IUPAC Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]acetamide Traditional Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]acetamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=CC=C(C=C2)NC(=O)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=CC=C(C=C2)NC(=O)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H29N3O4S/c1-17-7-10-21(16-22(17)31(29,30)26-13-5-3-4-6-14-26)25-23(28)15-19-8-11-20(12-9-19)24-18(2)27/h7-12,16H,3-6,13-15H2,1-2H3,(H,24,27)(H,25,28)