2-[(3-chloranyl-2-methyl-phenyl)-(phenylsulfonyl)amino]-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)-(phenylsulfonyl)amino]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-chloro-2-methyl-anilino]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-chloro-2-methylanilino]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-chloro-2-methylanilino]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-3-chloro-2-methyl-anilino)-N-(3-imidazol-1-ylpropyl)acetamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4O3S/c1-17-19(22)9-5-10-20(17)26(30(28,29)18-7-3-2-4-8-18)15-21(27)24-11-6-13-25-14-12-23-16-25/h2-5,7-10,12,14,16H,6,11,13,15H2,1H3,(H,24,27)