N-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-[2-(1H-indol-3-yl)ethyl]amine Formula: C21H19F3N4O2 MolecularWeight: 416.39637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCCC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCCC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C21H19F3N4O2/c1-29-17-9-14-16(10-18(17)30-2)27-20(21(22,23)24)28-19(14)25-8-7-12-11-26-15-6-4-3-5-13(12)15/h3-6,9-11,26H,7-8H2,1-2H3,(H,25,27,28)