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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])SC

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])SC

InChI

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