2-methylsulfanyl-7-(3-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 2-methylsulfanyl-7-(3-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 2-methylsulfanyl-7-(3-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 2-(methylthio)-7-(3-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 2-methylsulfanyl-7-(3-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 2-(methylthio)-7-(3-nitrophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C12H9N5O2S MolecularWeight: 287.29716

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN2C(=CC=NC2=N1)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=NN2C(=CC=NC2=N1)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O2S/c1-20-12-14-11-13-6-5-10(16(11)15-12)8-3-2-4-9(7-8)17(18)19/h2-7H,1H3