2-[4-[(6-cyclopropyl-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(6-cyclopropyl-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(6-cyclopropyl-2-methyl-4-oxo-1H-pyrimidin-5-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(6-cyclopropyl-2-methyl-4-oxo-1H-pyrimidin-5-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(6-cyclopropyl-2-methyl-4-oxo-1H-pyrimidin-5-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(6-cyclopropyl-4-keto-2-methyl-1H-pyrimidin-5-yl)methyl]phenyl]benzonitrile Formula: C22H19N3O MolecularWeight: 341.40576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C2CC2)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=NC(=O)C(=C(N1)C2CC2)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H19N3O/c1-14-24-21(17-10-11-17)20(22(26)25-14)12-15-6-8-16(9-7-15)19-5-3-2-4-18(19)13-23/h2-9,17H,10-12H2,1H3,(H,24,25,26)