N-(3-imidazol-1-ylpropyl)-2-[(2-methylphenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[(2-methylphenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-2-methyl-anilino]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-2-methylanilino]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-2-methylanilino]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-2-methyl-anilino)-N-(3-imidazol-1-ylpropyl)acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-18-8-5-6-11-20(18)25(29(27,28)19-9-3-2-4-10-19)16-21(26)23-12-7-14-24-15-13-22-17-24/h2-6,8-11,13,15,17H,7,12,14,16H2,1H3,(H,23,26)