4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]butanamide Openeye Name: 4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]butanamide CAS Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[[2-(2-methyl-1-imidazolyl)phenyl]methyl]butanamide IUPAC Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]butanamide Traditional Name: 4-(N-mesyl-2,5-dimethyl-anilino)-N-[2-(2-methylimidazol-1-yl)benzyl]butyramide Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCCC(=O)NCC2=CC=CC=C2N3C=CN=C3C)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCCC(=O)NCC2=CC=CC=C2N3C=CN=C3C)S(=O)(=O)C

InChI

InChI=1S/C24H30N4O3S/c1-18-11-12-19(2)23(16-18)28(32(4,30)31)14-7-10-24(29)26-17-21-8-5-6-9-22(21)27-15-13-25-20(27)3/h5-6,8-9,11-13,15-16H,7,10,14,17H2,1-4H3,(H,26,29)