5-methylsulfanyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-amine

Systemtic Name: 5-methylsulfanyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-amine Openeye Name: 5-methylsulfanyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-amine CAS Name: 5-(methylthio)-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-amine IUPAC Name: 5-methylsulfanyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [5-(methylthio)-4-(4-nitrobenzyl)-1,2,4-triazol-3-yl]amine Formula: C10H11N5O2S MolecularWeight: 265.29164

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C10H11N5O2S/c1-18-10-13-12-9(11)14(10)6-7-2-4-8(5-3-7)15(16)17/h2-5H,6H2,1H3,(H2,11,12)