1-(2,5-dimethyl-4-nitro-pyrazol-3-yl)-3-methylsulfanyl-5-thiophen-2-yl-pyrazole-4-carbonitrile

Systemtic Name: 1-(2,5-dimethyl-4-nitro-pyrazol-3-yl)-3-methylsulfanyl-5-thiophen-2-yl-pyrazole-4-carbonitrile Openeye Name: 1-(2,5-dimethyl-4-nitro-pyrazol-3-yl)-3-methylsulfanyl-5-(2-thienyl)pyrazole-4-carbonitrile CAS Name: 1-(2,5-dimethyl-4-nitro-3-pyrazolyl)-3-(methylthio)-5-thiophen-2-yl-4-pyrazolecarbonitrile IUPAC Name: 1-(2,5-dimethyl-4-nitropyrazol-3-yl)-3-methylsulfanyl-5-thiophen-2-ylpyrazole-4-carbonitrile Traditional Name: 1-(2,5-dimethyl-4-nitro-pyrazol-3-yl)-3-(methylthio)-5-(2-thienyl)pyrazole-4-carbonitrile Formula: C14H12N6O2S2 MolecularWeight: 360.41408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])N2C(=C(C(=N2)SC)C#N)C3=CC=CS3)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])N2C(=C(C(=N2)SC)C#N)C3=CC=CS3)C

InChI

InChI=1S/C14H12N6O2S2/c1-8-11(20(21)22)14(18(2)16-8)19-12(10-5-4-6-24-10)9(7-15)13(17-19)23-3/h4-6H,1-3H3