2-phenyl-6,6-bis(trifluoromethyl)-3-(2,4,6-trimethylphenyl)-4,5-dihydropyrimidine-5-carbonitrile

Systemtic Name: 2-phenyl-6,6-bis(trifluoromethyl)-3-(2,4,6-trimethylphenyl)-4,5-dihydropyrimidine-5-carbonitrile Openeye Name: 2-phenyl-6,6-bis(trifluoromethyl)-3-(2,4,6-trimethylphenyl)-4,5-dihydropyrimidine-5-carbonitrile CAS Name: 2-phenyl-6,6-bis(trifluoromethyl)-3-(2,4,6-trimethylphenyl)-4,5-dihydropyrimidine-5-carbonitrile IUPAC Name: 2-phenyl-6,6-bis(trifluoromethyl)-3-(2,4,6-trimethylphenyl)-4,5-dihydropyrimidine-5-carbonitrile Traditional Name: 3-mesityl-2-phenyl-6,6-bis(trifluoromethyl)-4,5-dihydropyrimidine-5-carbonitrile Formula: C22H19F6N3 MolecularWeight: 439.396779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2CC(C(N=C2C3=CC=CC=C3)(C(F)(F)F)C(F)(F)F)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2CC(C(N=C2C3=CC=CC=C3)(C(F)(F)F)C(F)(F)F)C#N)C

InChI

InChI=1S/C22H19F6N3/c1-13-9-14(2)18(15(3)10-13)31-12-17(11-29)20(21(23,24)25,22(26,27)28)30-19(31)16-7-5-4-6-8-16/h4-10,17H,12H2,1-3H3