methyl 2-[[3-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[3-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]sulfamoyl]benzoate Openeye Name: methyl 2-[[3-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]sulfamoyl]benzoate CAS Name: 2-[[3-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]sulfamoyl]benzoate Traditional Name: 2-[[3-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C15H12N5O4S- MolecularWeight: 358.35188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)NC2=CC=CC(=C2)C3=NN=N[N-]3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)NC2=CC=CC(=C2)C3=NN=N[N-]3

InChI

InChI=1S/C15H12N5O4S/c1-24-15(21)12-7-2-3-8-13(12)25(22,23)18-11-6-4-5-10(9-11)14-16-19-20-17-14/h2-9,18H,1H3/q-1