5-bromanyl-N4-(2-pyridin-2-ylethyl)-N2-quinolin-6-yl-pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N4-(2-pyridin-2-ylethyl)-N2-quinolin-6-yl-pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-[2-(2-pyridyl)ethyl]-N2-(6-quinolyl)pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-[2-(2-pyridinyl)ethyl]-N2-(6-quinolinyl)pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-(2-pyridin-2-ylethyl)-2-N-quinolin-6-ylpyrimidine-2,4-diamine Traditional Name: [5-bromo-4-[2-(2-pyridyl)ethylamino]pyrimidin-2-yl]-(6-quinolyl)amine Formula: C20H17BrN6 MolecularWeight: 421.29318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCNC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

C1=CC=NC(=C1)CCNC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C20H17BrN6/c21-17-13-25-20(26-16-6-7-18-14(12-16)4-3-10-23-18)27-19(17)24-11-8-15-5-1-2-9-22-15/h1-7,9-10,12-13H,8,11H2,(H2,24,25,26,27)