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

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

CC(C)C1=NN=C(N1C)SCN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NN=C(N1C)SCN2C=C(C=N2)[N+](=O)[O-]

InChI

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