2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[2-(imidazol-1-ylmethyl)benzyl]acetamide Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1CN2C=CN=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1CN2C=CN=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN4O3S/c1-29(27,28)25(19-8-4-7-18(21)11-19)14-20(26)23-12-16-5-2-3-6-17(16)13-24-10-9-22-15-24/h2-11,15H,12-14H2,1H3,(H,23,26)