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

Systemtic Name: 3-(4-ethyl-5-methyl-thiophen-3-yl)-4-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-ethyl-5-methyl-3-thienyl)-4-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-ethyl-5-methyl-3-thiophenyl)-4-methyl-5-[(4-nitro-1-pyrazolyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-ethyl-5-methyl-3-thienyl)-4-methyl-5-[(4-nitropyrazol-1-yl)methylthio]-1,2,4-triazole Formula: C14H16N6O2S2 MolecularWeight: 364.44584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C2=NN=C(N2C)SCN3C=C(C=N3)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC=C1C2=NN=C(N2C)SCN3C=C(C=N3)[N+](=O)[O-])C

InChI

InChI=1S/C14H16N6O2S2/c1-4-11-9(2)23-7-12(11)13-16-17-14(18(13)3)24-8-19-6-10(5-15-19)20(21)22/h5-7H,4,8H2,1-3H3