(2-phenylazanyl-1,3-thiazol-4-yl)methyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate Openeye Name: (2-anilinothiazol-4-yl)methyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate CAS Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]benzoic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]benzoate Traditional Name: 3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]benzoic acid (2-anilinothiazol-4-yl)methyl ester Formula: C28H25N5O5S2 MolecularWeight: 575.6586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CSC(=N4)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CSC(=N4)NC5=CC=CC=C5

InChI

InChI=1S/C28H25N5O5S2/c1-19-25(26(34)33(32(19)2)23-13-7-4-8-14-23)31-40(36,37)24-15-9-10-20(16-24)27(35)38-17-22-18-39-28(30-22)29-21-11-5-3-6-12-21/h3-16,18,31H,17H2,1-2H3,(H,29,30)