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

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[(3-methylphenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-methyl-anilino]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-methylanilino]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-methylanilino]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-3-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=C1)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CC=C3

InChI

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