ethyl 5-oxidanylidene-1-phenyl-4-[[4-(1,3-thiazol-2-ylsulfonylamino)phenyl]diazenyl]-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-1-phenyl-4-[[4-(1,3-thiazol-2-ylsulfonylamino)phenyl]diazenyl]-4H-pyrazole-3-carboxylate Openeye Name: ethyl 5-oxo-1-phenyl-4-[4-(thiazol-2-ylsulfonylamino)phenyl]azo-4H-pyrazole-3-carboxylate CAS Name: 5-oxo-1-phenyl-4-[4-(2-thiazolylsulfonylamino)phenyl]azo-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-1-phenyl-4-[[4-(1,3-thiazol-2-ylsulfonylamino)phenyl]diazenyl]-4H-pyrazole-3-carboxylate Traditional Name: 5-keto-1-phenyl-4-[4-(thiazol-2-ylsulfonylamino)phenyl]azo-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C21H18N6O5S2 MolecularWeight: 498.53482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=C(C=C2)NS(=O)(=O)C3=NC=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=C(C=C2)NS(=O)(=O)C3=NC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N6O5S2/c1-2-32-20(29)18-17(19(28)27(25-18)16-6-4-3-5-7-16)24-23-14-8-10-15(11-9-14)26-34(30,31)21-22-12-13-33-21/h3-13,17,26H,2H2,1H3