6,7-dimethoxy-N-[2,3,5-tris(fluoranyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine

Systemtic Name: 6,7-dimethoxy-N-[2,3,5-tris(fluoranyl)phenyl]-1,4,4a,8a-tetrahydroquinazolin-2-amine Openeye Name: 6,7-dimethoxy-N-(2,3,5-trifluorophenyl)-1,4,4a,8a-tetrahydroquinazolin-2-amine CAS Name: 6,7-dimethoxy-N-(2,3,5-trifluorophenyl)-1,4,4a,8a-tetrahydroquinazolin-2-amine IUPAC Name: 6,7-dimethoxy-N-(2,3,5-trifluorophenyl)-1,4,4a,8a-tetrahydroquinazolin-2-amine Traditional Name: (6,7-dimethoxy-1,4,4a,8a-tetrahydroquinazolin-2-yl)-(2,3,5-trifluorophenyl)amine Formula: C16H16F3N3O2 MolecularWeight: 339.31235

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2CN=C(NC2C=C1OC)NC3=CC(=CC(=C3F)F)F

Isomeric SMILES

COC1=CC2CN=C(NC2C=C1OC)NC3=CC(=CC(=C3F)F)F

InChI

InChI=1S/C16H16F3N3O2/c1-23-13-3-8-7-20-16(21-11(8)6-14(13)24-2)22-12-5-9(17)4-10(18)15(12)19/h3-6,8,11H,7H2,1-2H3,(H2,20,21,22)