4-(6,7-dimethoxyquinazolin-4-yl)-2-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-2-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-2-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-2-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-2-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-2-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C22H22F3N5O3 MolecularWeight: 461.43699

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(C(C3)C4=CC(=CC=C4)C(F)(F)F)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(C(C3)C4=CC(=CC=C4)C(F)(F)F)C(=O)N)OC

InChI

InChI=1S/C22H22F3N5O3/c1-32-18-9-15-16(10-19(18)33-2)27-12-28-20(15)29-6-7-30(21(26)31)17(11-29)13-4-3-5-14(8-13)22(23,24)25/h3-5,8-10,12,17H,6-7,11H2,1-2H3,(H2,26,31)