N-(3-imidazol-1-ylpropyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-(3-imidazol-1-ylpropyl)amine Formula: C17H18F3N5O2 MolecularWeight: 381.35233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCCCN3C=CN=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCCCN3C=CN=C3)OC

InChI

InChI=1S/C17H18F3N5O2/c1-26-13-8-11-12(9-14(13)27-2)23-16(17(18,19)20)24-15(11)22-4-3-6-25-7-5-21-10-25/h5,7-10H,3-4,6H2,1-2H3,(H,22,23,24)