1-butan-2-yl-7-(4-methylphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 1-butan-2-yl-7-(4-methylphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Openeye Name: 7-(p-tolyl)-1-sec-butyl-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one CAS Name: 1-butan-2-yl-7-(4-methylphenyl)-2-sulfanylidene-5-(trifluoromethyl)-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 1-butan-2-yl-7-(4-methylphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Traditional Name: 7-(p-tolyl)-1-sec-butyl-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one Formula: C19H18F3N3OS MolecularWeight: 393.42593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C(=CC(=N2)C3=CC=C(C=C3)C)C(F)(F)F)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C2=C(C(=CC(=N2)C3=CC=C(C=C3)C)C(F)(F)F)C(=O)NC1=S

InChI

InChI=1S/C19H18F3N3OS/c1-4-11(3)25-16-15(17(26)24-18(25)27)13(19(20,21)22)9-14(23-16)12-7-5-10(2)6-8-12/h5-9,11H,4H2,1-3H3,(H,24,26,27)