(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-(4-nitrophenyl)methanone

Systemtic Name: (5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-(4-nitrophenyl)methanone Openeye Name: (5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-(4-nitrophenyl)methanone CAS Name: [5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: (5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-(4-nitrophenyl)methanone Traditional Name: [5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Formula: C10H9N5O3S MolecularWeight: 279.27516

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=NN(C(=N1)N)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O3S/c1-19-10-12-9(11)14(13-10)8(16)6-2-4-7(5-3-6)15(17)18/h2-5H,1H3,(H2,11,12,13)