3-methylsulfanyl-5-(3-nitrophenyl)-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-5-(3-nitrophenyl)-1H-pyrazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-5-(3-nitrophenyl)-1H-pyrazole-4-carbonitrile CAS Name: 3-(methylthio)-5-(3-nitrophenyl)-1H-pyrazole-4-carbonitrile IUPAC Name: 3-methylsulfanyl-5-(3-nitrophenyl)-1H-pyrazole-4-carbonitrile Traditional Name: 3-(methylthio)-5-(3-nitrophenyl)-1H-pyrazole-4-carbonitrile Formula: C11H8N4O2S MolecularWeight: 260.27182

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=C1C#N)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=NNC(=C1C#N)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O2S/c1-18-11-9(6-12)10(13-14-11)7-3-2-4-8(5-7)15(16)17/h2-5H,1H3,(H,13,14)