N4-(1H-indazol-3-yl)-N2-[3-(trifluoromethyl)phenyl]quinazoline-2,4-diamine

Systemtic Name: N4-(1H-indazol-3-yl)-N2-[3-(trifluoromethyl)phenyl]quinazoline-2,4-diamine Openeye Name: N4-(1H-indazol-3-yl)-N2-[3-(trifluoromethyl)phenyl]quinazoline-2,4-diamine CAS Name: N4-(1H-indazol-3-yl)-N2-[3-(trifluoromethyl)phenyl]quinazoline-2,4-diamine IUPAC Name: 4-N-(1H-indazol-3-yl)-2-N-[3-(trifluoromethyl)phenyl]quinazoline-2,4-diamine Traditional Name: 1H-indazol-3-yl-[2-[3-(trifluoromethyl)anilino]quinazolin-4-yl]amine Formula: C22H15F3N6 MolecularWeight: 420.38991

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN2)NC3=NC(=NC4=CC=CC=C43)NC5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN2)NC3=NC(=NC4=CC=CC=C43)NC5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C22H15F3N6/c23-22(24,25)13-6-5-7-14(12-13)26-21-27-17-10-3-1-8-15(17)19(29-21)28-20-16-9-2-4-11-18(16)30-31-20/h1-12H,(H3,26,27,28,29,30,31)