N-[1-(3-acetamidophenyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloranyl-benzamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloranyl-benzamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-3-(1-azepanylsulfonyl)-4-chlorobenzamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chlorobenzamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H28ClN3O4S/c1-16(18-8-7-9-20(14-18)26-17(2)28)25-23(29)19-10-11-21(24)22(15-19)32(30,31)27-12-5-3-4-6-13-27/h7-11,14-16H,3-6,12-13H2,1-2H3,(H,25,29)(H,26,28)