4-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carbonitrile

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carbonitrile Openeye Name: 4-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carbonitrile CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carbonitrile IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carbonitrile Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carbonitrile Formula: C14H9F6N3O MolecularWeight: 349.231179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C14H9F6N3O/c1-6-10(5-21)11(23-12(24)22-6)7-2-8(13(15,16)17)4-9(3-7)14(18,19)20/h2-4,11H,1H3,(H2,22,23,24)