3-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-4-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-4-propan-2-yl-1,2,4-triazole Openeye Name: 4-isopropyl-3-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-methyl-5-[(4-nitro-1-pyrazolyl)methylthio]-4-propan-2-yl-1,2,4-triazole IUPAC Name: 3-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-4-propan-2-yl-1,2,4-triazole Traditional Name: 4-isopropyl-3-methyl-5-[(4-nitropyrazol-1-yl)methylthio]-1,2,4-triazole Formula: C10H14N6O2S MolecularWeight: 282.32216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C(C)C)SCN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(N1C(C)C)SCN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N6O2S/c1-7(2)15-8(3)12-13-10(15)19-6-14-5-9(4-11-14)16(17)18/h4-5,7H,6H2,1-3H3