6-chloranyl-3-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-4-phenyl-1H-quinolin-2-one Openeye Name: 6-chloro-3-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-chloro-3-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-4-phenyl-1H-quinolin-2-one Traditional Name: 6-chloro-3-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]-4-phenyl-carbostyril Formula: C21H13ClF3N3OS MolecularWeight: 447.86063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H13ClF3N3OS/c1-11-9-16(21(23,24)25)28-20(26-11)30-18-17(12-5-3-2-4-6-12)14-10-13(22)7-8-15(14)27-19(18)29/h2-10H,1H3,(H,27,29)