7-chloranyl-2-methylsulfanyl-5-(pyridin-2-ylmethoxy)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline

Systemtic Name: 7-chloranyl-2-methylsulfanyl-5-(pyridin-2-ylmethoxy)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline Openeye Name: 7-chloro-2-methylsulfanyl-5-(2-pyridylmethoxy)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline CAS Name: 7-chloro-2-(methylthio)-5-(2-pyridinylmethoxy)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline IUPAC Name: 7-chloro-2-methylsulfanyl-5-(pyridin-2-ylmethoxy)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline Traditional Name: 7-chloro-2-(methylthio)-5-(2-pyridylmethoxy)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline Formula: C19H14ClF3N4OS MolecularWeight: 438.85387

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C2C(=N1)NC3=C(C2(C(F)(F)F)OCC4=CC=CC=N4)C=C(C=C3)Cl

Isomeric SMILES

CSC1=NC=C2C(=N1)NC3=C(C2(C(F)(F)F)OCC4=CC=CC=N4)C=C(C=C3)Cl

InChI

InChI=1S/C19H14ClF3N4OS/c1-29-17-25-9-14-16(27-17)26-15-6-5-11(20)8-13(15)18(14,19(21,22)23)28-10-12-4-2-3-7-24-12/h2-9H,10H2,1H3,(H,25,26,27)