6,7-dimethoxy-2-thiophen-2-yl-4-[4-[2-(trifluoromethyl)phenyl]piperazin-1-yl]quinazoline

Systemtic Name: 6,7-dimethoxy-2-thiophen-2-yl-4-[4-[2-(trifluoromethyl)phenyl]piperazin-1-yl]quinazoline Openeye Name: 6,7-dimethoxy-2-(2-thienyl)-4-[4-[2-(trifluoromethyl)phenyl]piperazin-1-yl]quinazoline CAS Name: 6,7-dimethoxy-2-thiophen-2-yl-4-[4-[2-(trifluoromethyl)phenyl]-1-piperazinyl]quinazoline IUPAC Name: 6,7-dimethoxy-2-thiophen-2-yl-4-[4-[2-(trifluoromethyl)phenyl]piperazin-1-yl]quinazoline Traditional Name: 6,7-dimethoxy-2-(2-thienyl)-4-[4-[2-(trifluoromethyl)phenyl]piperazino]quinazoline Formula: C25H23F3N4O2S MolecularWeight: 500.53593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=CS3)N4CCN(CC4)C5=CC=CC=C5C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C3=CC=CS3)N4CCN(CC4)C5=CC=CC=C5C(F)(F)F)OC

InChI

InChI=1S/C25H23F3N4O2S/c1-33-20-14-16-18(15-21(20)34-2)29-23(22-8-5-13-35-22)30-24(16)32-11-9-31(10-12-32)19-7-4-3-6-17(19)25(26,27)28/h3-8,13-15H,9-12H2,1-2H3