5,7-dimethyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide

Systemtic Name: 5,7-dimethyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide Openeye Name: 5,7-dimethyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide CAS Name: 5,7-dimethyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide IUPAC Name: 5,7-dimethyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide Traditional Name: 5,7-dimethyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide Formula: C13H12N6O4S MolecularWeight: 348.33718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=NN12)S(=O)(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC2=NC(=NN12)S(=O)(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C13H12N6O4S/c1-8-7-9(2)18-12(14-8)15-13(16-18)24(22,23)17-10-3-5-11(6-4-10)19(20)21/h3-7,17H,1-2H3