4-[1,5-bis(4-methylphenyl)pyrazol-3-yl]-3-(3-methylphenyl)butanenitrile

Systemtic Name: 4-[1,5-bis(4-methylphenyl)pyrazol-3-yl]-3-(3-methylphenyl)butanenitrile Openeye Name: 4-[1,5-bis(p-tolyl)pyrazol-3-yl]-3-(m-tolyl)butanenitrile CAS Name: 4-[1,5-bis(4-methylphenyl)-3-pyrazolyl]-3-(3-methylphenyl)butanenitrile IUPAC Name: 4-[1,5-bis(4-methylphenyl)pyrazol-3-yl]-3-(3-methylphenyl)butanenitrile Traditional Name: 4-[1,5-bis(p-tolyl)pyrazol-3-yl]-3-(m-tolyl)butyronitrile Formula: C28H27N3 MolecularWeight: 405.53408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C)CC(CC#N)C4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C)CC(CC#N)C4=CC=CC(=C4)C

InChI

InChI=1S/C28H27N3/c1-20-7-11-23(12-8-20)28-19-26(30-31(28)27-13-9-21(2)10-14-27)18-25(15-16-29)24-6-4-5-22(3)17-24/h4-14,17,19,25H,15,18H2,1-3H3