N2-(5-chloranyl-2-methoxy-phenyl)-5-methyl-N7-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine

Systemtic Name: N2-(5-chloranyl-2-methoxy-phenyl)-5-methyl-N7-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine Openeye Name: N2-(5-chloro-2-methoxy-phenyl)-5-methyl-N7-[2-(4-pyridyl)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine CAS Name: N2-(5-chloro-2-methoxyphenyl)-5-methyl-N7-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine IUPAC Name: 2-N-(5-chloro-2-methoxyphenyl)-5-methyl-7-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine Traditional Name: [2-(5-chloro-2-methoxy-anilino)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-[2-(4-pyridyl)ethyl]amine Formula: C20H20ClN7O MolecularWeight: 409.8721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NN2C(=C1)NCCC3=CC=NC=C3)NC4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=NC2=NC(=NN2C(=C1)NCCC3=CC=NC=C3)NC4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C20H20ClN7O/c1-13-11-18(23-10-7-14-5-8-22-9-6-14)28-20(24-13)26-19(27-28)25-16-12-15(21)3-4-17(16)29-2/h3-6,8-9,11-12,23H,7,10H2,1-2H3,(H,25,27)