6-oxidanylidene-3-phenyl-4-sulfanyl-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]-1,2-dihydropyrimidine-5-carbonitrile

Systemtic Name: 6-oxidanylidene-3-phenyl-4-sulfanyl-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]-1,2-dihydropyrimidine-5-carbonitrile Openeye Name: 6-oxo-3-phenyl-4-sulfanyl-2-[5-[3-(trifluoromethyl)phenyl]-2-furyl]-1,2-dihydropyrimidine-5-carbonitrile CAS Name: 4-mercapto-6-oxo-3-phenyl-2-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]-1,2-dihydropyrimidine-5-carbonitrile IUPAC Name: 6-oxo-3-phenyl-4-sulfanyl-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]-1,2-dihydropyrimidine-5-carbonitrile Traditional Name: 6-keto-4-mercapto-3-phenyl-2-[5-[3-(trifluoromethyl)phenyl]-2-furyl]-1,2-dihydropyrimidine-5-carbonitrile Formula: C22H14F3N3O2S MolecularWeight: 441.42567

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H14F3N3O2S/c23-22(24,25)14-6-4-5-13(11-14)17-9-10-18(30-17)19-27-20(29)16(12-26)21(31)28(19)15-7-2-1-3-8-15/h1-11,19,31H,(H,27,29)