2-[(3,5-dimethylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-[3,5-dimethyl-N-(p-tolylsulfonyl)anilino]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-(3,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-(3,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-(3,5-dimethyl-N-tosyl-anilino)-N-(3-imidazol-1-ylpropyl)acetamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O3S/c1-18-5-7-22(8-6-18)31(29,30)27(21-14-19(2)13-20(3)15-21)16-23(28)25-9-4-11-26-12-10-24-17-26/h5-8,10,12-15,17H,4,9,11,16H2,1-3H3,(H,25,28)