2,4-diphenyl-2-(pyrimidin-5-ylmethyl)butanenitrile

Systemtic Name: 2,4-diphenyl-2-(pyrimidin-5-ylmethyl)butanenitrile Openeye Name: 2,4-diphenyl-2-(pyrimidin-5-ylmethyl)butanenitrile CAS Name: 2,4-diphenyl-2-(5-pyrimidinylmethyl)butanenitrile IUPAC Name: 2,4-diphenyl-2-(pyrimidin-5-ylmethyl)butanenitrile Traditional Name: 2,4-diphenyl-2-(5-pyrimidylmethyl)butyronitrile Formula: C21H19N3 MolecularWeight: 313.39566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CC2=CN=CN=C2)(C#N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCC(CC2=CN=CN=C2)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3/c22-16-21(20-9-5-2-6-10-20,13-19-14-23-17-24-15-19)12-11-18-7-3-1-4-8-18/h1-10,14-15,17H,11-13H2