6,7-dimethoxy-N-(3-methylsulfanylphenyl)-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: 6,7-dimethoxy-N-(3-methylsulfanylphenyl)-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: 6,7-dimethoxy-N-(3-methylsulfanylphenyl)-2-(trifluoromethyl)quinazolin-4-amine CAS Name: 6,7-dimethoxy-N-[3-(methylthio)phenyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: 6,7-dimethoxy-N-(3-methylsulfanylphenyl)-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-[3-(methylthio)phenyl]amine Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC(=CC=C3)SC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC(=CC=C3)SC)OC

InChI

InChI=1S/C18H16F3N3O2S/c1-25-14-8-12-13(9-15(14)26-2)23-17(18(19,20)21)24-16(12)22-10-5-4-6-11(7-10)27-3/h4-9H,1-3H3,(H,22,23,24)