6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline

Systemtic Name: 6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline Openeye Name: 6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline CAS Name: 6,7-dimethoxy-4-(4-phenyl-1-piperazinyl)-2-(trifluoromethyl)quinazoline IUPAC Name: 6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline Traditional Name: 6,7-dimethoxy-4-(4-phenylpiperazino)-2-(trifluoromethyl)quinazoline Formula: C21H21F3N4O2 MolecularWeight: 418.41225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)N3CCN(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)N3CCN(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H21F3N4O2/c1-29-17-12-15-16(13-18(17)30-2)25-20(21(22,23)24)26-19(15)28-10-8-27(9-11-28)14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3