5-bromanyl-N2-quinolin-6-yl-N4-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N2-quinolin-6-yl-N4-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-(6-quinolyl)-N4-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-(6-quinolinyl)-N4-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-quinolin-6-yl-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine Traditional Name: [5-bromo-2-(6-quinolylamino)pyrimidin-4-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C20H13BrF3N5 MolecularWeight: 460.24993

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC3=NC=C(C(=N3)NC4=CC=C(C=C4)C(F)(F)F)Br)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)NC3=NC=C(C(=N3)NC4=CC=C(C=C4)C(F)(F)F)Br)N=C1

InChI

InChI=1S/C20H13BrF3N5/c21-16-11-26-19(28-15-7-8-17-12(10-15)2-1-9-25-17)29-18(16)27-14-5-3-13(4-6-14)20(22,23)24/h1-11H,(H2,26,27,28,29)