4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)pyrazole-3-carbonitrile

Systemtic Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)pyrazole-3-carbonitrile Openeye Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)pyrazole-3-carbonitrile CAS Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)-3-pyrazolecarbonitrile IUPAC Name: 4-(4-methylsulfonylphenyl)-1-(4-nitrophenyl)pyrazole-3-carbonitrile Traditional Name: 4-(4-mesylphenyl)-1-(4-nitrophenyl)pyrazole-3-carbonitrile Formula: C17H12N4O4S MolecularWeight: 368.36658

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN(N=C2C#N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN(N=C2C#N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O4S/c1-26(24,25)15-8-2-12(3-9-15)16-11-20(19-17(16)10-18)13-4-6-14(7-5-13)21(22)23/h2-9,11H,1H3