methyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-4-oxo-butanoate CAS Name: 4-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-4-oxobutanoate Traditional Name: 4-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-4-keto-butyric acid methyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)OC)C

InChI

InChI=1S/C17H20N4O5S/c1-11-10-12(2)19-17(18-11)21-27(24,25)14-6-4-13(5-7-14)20-15(22)8-9-16(23)26-3/h4-7,10H,8-9H2,1-3H3,(H,20,22)(H,18,19,21)