3-(5-methylthiophen-3-yl)-5-[(4-nitropyrazol-1-yl)methylsulfanyl]-4-propyl-1,2,4-triazole

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCN2C=C(C=N2)[N+](=O)[O-])C3=CSC(=C3)C

Isomeric SMILES

CCCN1C(=NN=C1SCN2C=C(C=N2)[N+](=O)[O-])C3=CSC(=C3)C

InChI

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