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

Systemtic Name: 7-chloranyl-5-(cyclopropylmethoxy)-2-methylsulfanyl-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline Openeye Name: 7-chloro-5-(cyclopropylmethoxy)-2-methylsulfanyl-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline CAS Name: 7-chloro-5-(cyclopropylmethoxy)-2-(methylthio)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline IUPAC Name: 7-chloro-5-(cyclopropylmethoxy)-2-methylsulfanyl-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline Traditional Name: 7-chloro-5-(cyclopropylmethoxy)-2-(methylthio)-5-(trifluoromethyl)-10H-pyrimido[4,5-b]quinoline Formula: C17H15ClF3N3OS MolecularWeight: 401.83371

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C2C(=N1)NC3=C(C2(C(F)(F)F)OCC4CC4)C=C(C=C3)Cl

Isomeric SMILES

CSC1=NC=C2C(=N1)NC3=C(C2(C(F)(F)F)OCC4CC4)C=C(C=C3)Cl

InChI

InChI=1S/C17H15ClF3N3OS/c1-26-15-22-7-12-14(24-15)23-13-5-4-10(18)6-11(13)16(12,17(19,20)21)25-8-9-2-3-9/h4-7,9H,2-3,8H2,1H3,(H,22,23,24)