N-(1,3-benzodioxol-5-yl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-6-methyl-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C17H12F3N3O2 MolecularWeight: 347.29129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NC3=CC4=C(C=C3)OCO4)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NC3=CC4=C(C=C3)OCO4)C(F)(F)F

InChI

InChI=1S/C17H12F3N3O2/c1-9-2-4-12-11(6-9)15(23-16(22-12)17(18,19)20)21-10-3-5-13-14(7-10)25-8-24-13/h2-7H,8H2,1H3,(H,21,22,23)