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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6-methyl-2-(trifluoromethyl)quinazolin-4-yl]-piperonyl-amine Formula: C18H14F3N3O2 MolecularWeight: 361.31787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NCC3=CC4=C(C=C3)OCO4)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NCC3=CC4=C(C=C3)OCO4)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2/c1-10-2-4-13-12(6-10)16(24-17(23-13)18(19,20)21)22-8-11-3-5-14-15(7-11)26-9-25-14/h2-7H,8-9H2,1H3,(H,22,23,24)