N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C18H14F3N3O2 MolecularWeight: 361.31787

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C(F)(F)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC3=NC(=NC4=CC=CC=C43)C(F)(F)F)OC1

InChI

InChI=1S/C18H14F3N3O2/c19-18(20,21)17-23-13-5-2-1-4-12(13)16(24-17)22-11-6-7-14-15(10-11)26-9-3-8-25-14/h1-2,4-7,10H,3,8-9H2,(H,22,23,24)