ethyl 5-[isoquinolin-1-yl-(5-oxidanylidene-1H-1,2,4-triazol-4-yl)sulfamoyl]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[isoquinolin-1-yl-(5-oxidanylidene-1H-1,2,4-triazol-4-yl)sulfamoyl]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[1-isoquinolyl-(5-oxo-1H-1,2,4-triazol-4-yl)sulfamoyl]-1H-pyrazole-4-carboxylate CAS Name: 5-[1-isoquinolinyl-(5-oxo-1H-1,2,4-triazol-4-yl)sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[isoquinolin-1-yl-(5-oxo-1H-1,2,4-triazol-4-yl)sulfamoyl]-1H-pyrazole-4-carboxylate Traditional Name: 5-[1-isoquinolyl-(5-keto-1H-1,2,4-triazol-4-yl)sulfamoyl]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C17H15N7O5S MolecularWeight: 429.4099

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N(C2=NC=CC3=CC=CC=C32)N4C=NNC4=O

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N(C2=NC=CC3=CC=CC=C32)N4C=NNC4=O

InChI

InChI=1S/C17H15N7O5S/c1-2-29-16(25)13-9-19-21-15(13)30(27,28)24(23-10-20-22-17(23)26)14-12-6-4-3-5-11(12)7-8-18-14/h3-10H,2H2,1H3,(H,19,21)(H,22,26)