4-methyl-3-methylsulfanyl-5-(3-nitrophenyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-methylsulfanyl-5-(3-nitrophenyl)-1,2,4-triazole Openeye Name: 4-methyl-3-methylsulfanyl-5-(3-nitrophenyl)-1,2,4-triazole CAS Name: 4-methyl-3-(methylthio)-5-(3-nitrophenyl)-1,2,4-triazole IUPAC Name: 4-methyl-3-methylsulfanyl-5-(3-nitrophenyl)-1,2,4-triazole Traditional Name: 4-methyl-3-(methylthio)-5-(3-nitrophenyl)-1,2,4-triazole Formula: C10H10N4O2S MolecularWeight: 250.277

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=C1SC)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O2S/c1-13-9(11-12-10(13)17-2)7-4-3-5-8(6-7)14(15)16/h3-6H,1-2H3