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

Systemtic Name: ethyl 4-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C18H22N4O5S MolecularWeight: 406.45608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C18H22N4O5S/c1-4-27-17(24)10-9-16(23)21-14-5-7-15(8-6-14)28(25,26)22-18-19-12(2)11-13(3)20-18/h5-8,11H,4,9-10H2,1-3H3,(H,21,23)(H,19,20,22)