3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[4-(3,5-diphenyl-1-pyrazolyl)phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-2-tosyl-acrylonitrile Formula: C31H23N3O2S MolecularWeight: 501.59822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(C=C2)N3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(C=C2)N3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C31H23N3O2S/c1-23-12-18-28(19-13-23)37(35,36)29(22-32)20-24-14-16-27(17-15-24)34-31(26-10-6-3-7-11-26)21-30(33-34)25-8-4-2-5-9-25/h2-21H,1H3