6-(4-methoxyphenyl)-4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]methylamino]-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]methylamino]-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-4-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methoxyphenyl)-4-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-methoxyphenyl)-4-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-methoxyphenyl)-2-[[3-(trifluoromethyl)benzyl]amino]-1H-pyrimidine-5-carbonitrile Formula: C20H15F3N4O2 MolecularWeight: 400.35391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NCC3=CC(=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NCC3=CC(=CC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C20H15F3N4O2/c1-29-15-7-5-13(6-8-15)17-16(10-24)18(28)27-19(26-17)25-11-12-3-2-4-14(9-12)20(21,22)23/h2-9H,11H2,1H3,(H2,25,26,27,28)