4-[4-chloranyl-2-[1-(4-methylsulfonylphenyl)pyrazol-3-yl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-chloranyl-2-[1-(4-methylsulfonylphenyl)pyrazol-3-yl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-chloro-2-[1-(4-methylsulfonylphenyl)pyrazol-3-yl]phenyl]benzonitrile CAS Name: 4-[4-chloro-2-[1-(4-methylsulfonylphenyl)-3-pyrazolyl]phenyl]benzonitrile IUPAC Name: 4-[4-chloro-2-[1-(4-methylsulfonylphenyl)pyrazol-3-yl]phenyl]benzonitrile Traditional Name: 4-[4-chloro-2-[1-(4-mesylphenyl)pyrazol-3-yl]phenyl]benzonitrile Formula: C23H16ClN3O2S MolecularWeight: 433.91004

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C=CC(=N2)C3=C(C=CC(=C3)Cl)C4=CC=C(C=C4)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C=CC(=N2)C3=C(C=CC(=C3)Cl)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H16ClN3O2S/c1-30(28,29)20-9-7-19(8-10-20)27-13-12-23(26-27)22-14-18(24)6-11-21(22)17-4-2-16(15-25)3-5-17/h2-14H,1H3