methyl 4-methyl-3-[[4-(1-methylimidazol-2-yl)sulfanylphenyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-methyl-3-[[4-(1-methylimidazol-2-yl)sulfanylphenyl]sulfamoyl]benzoate Openeye Name: methyl 4-methyl-3-[[4-(1-methylimidazol-2-yl)sulfanylphenyl]sulfamoyl]benzoate CAS Name: 4-methyl-3-[[4-[(1-methyl-2-imidazolyl)thio]phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[4-(1-methylimidazol-2-yl)sulfanylphenyl]sulfamoyl]benzoate Traditional Name: 4-methyl-3-[[4-[(1-methylimidazol-2-yl)thio]phenyl]sulfamoyl]benzoic acid methyl ester Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC=C(C=C2)SC3=NC=CN3C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC=C(C=C2)SC3=NC=CN3C

InChI

InChI=1S/C19H19N3O4S2/c1-13-4-5-14(18(23)26-3)12-17(13)28(24,25)21-15-6-8-16(9-7-15)27-19-20-10-11-22(19)2/h4-12,21H,1-3H3