[2,4-bis(azanyl)quinazolin-6-yl]methyl 4-(trifluoromethyl)benzoate

Systemtic Name: [2,4-bis(azanyl)quinazolin-6-yl]methyl 4-(trifluoromethyl)benzoate Openeye Name: (2,4-diaminoquinazolin-6-yl)methyl 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid (2,4-diamino-6-quinazolinyl)methyl ester IUPAC Name: (2,4-diaminoquinazolin-6-yl)methyl 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid (2,4-diaminoquinazolin-6-yl)methyl ester Formula: C17H13F3N4O2 MolecularWeight: 362.30593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=CC3=C(C=C2)N=C(N=C3N)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=CC3=C(C=C2)N=C(N=C3N)N)C(F)(F)F

InChI

InChI=1S/C17H13F3N4O2/c18-17(19,20)11-4-2-10(3-5-11)15(25)26-8-9-1-6-13-12(7-9)14(21)24-16(22)23-13/h1-7H,8H2,(H4,21,22,23,24)