N6-[(4-chlorophenyl)methyl]-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-(5-methylisoxazol-3-yl)pyrimidine-4,5,6-triamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-(5-methyl-3-isoxazolyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-chlorobenzyl)amino]pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C15H15ClN6O MolecularWeight: 330.7722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CC1=CC(=NO1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C15H15ClN6O/c1-9-6-12(22-23-9)21-15-13(17)14(19-8-20-15)18-7-10-2-4-11(16)5-3-10/h2-6,8H,7,17H2,1H3,(H2,18,19,20,21,22)