3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Openeye Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine CAS Name: 3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methylthio]-5-methyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Traditional Name: [3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylthio]-5-methyl-1,2,4-triazol-4-yl]amine Formula: C9H13N7O2S MolecularWeight: 283.31022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CSC2=NN=C(N2N)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CSC2=NN=C(N2N)C)C)[N+](=O)[O-]

InChI

InChI=1S/C9H13N7O2S/c1-5-8(16(17)18)6(2)14(13-5)4-19-9-12-11-7(3)15(9)10/h4,10H2,1-3H3