1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C17H16F3N3OS MolecularWeight: 367.38865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCCC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCCC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C17H16F3N3OS/c1-11-9-14(17(18,19)20)22-16(21-11)25-10-15(24)23-8-4-6-12-5-2-3-7-13(12)23/h2-3,5,7,9H,4,6,8,10H2,1H3