N6-(5-chloranyl-2-methoxy-phenyl)-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(5-chloranyl-2-methoxy-phenyl)-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(5-chloro-2-methoxy-phenyl)-N4-ethyl-N4-(m-tolyl)pyrimidine-4,5,6-triamine CAS Name: N6-(5-chloro-2-methoxyphenyl)-N4-ethyl-N4-(3-methylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(5-chloro-2-methoxyphenyl)-4-N-ethyl-4-N-(3-methylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(5-chloro-2-methoxy-anilino)pyrimidin-4-yl]-ethyl-(m-tolyl)amine Formula: C20H22ClN5O MolecularWeight: 383.87458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2N)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H22ClN5O/c1-4-26(15-7-5-6-13(2)10-15)20-18(22)19(23-12-24-20)25-16-11-14(21)8-9-17(16)27-3/h5-12H,4,22H2,1-3H3,(H,23,24,25)