N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-(3,4-dimethoxyphenyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-(3,4-dimethoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-(3,4-dimethoxyphenyl)pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-(3,4-dimethoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-(3,4-dimethoxyphenyl)pyrimidine-4,6-diamine Traditional Name: [6-(3-chloro-4-fluoro-anilino)pyrimidin-4-yl]-(3,4-dimethoxyphenyl)amine Formula: C18H16ClFN4O2 MolecularWeight: 374.796643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=CC(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=CC(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC

InChI

InChI=1S/C18H16ClFN4O2/c1-25-15-6-4-12(8-16(15)26-2)24-18-9-17(21-10-22-18)23-11-3-5-14(20)13(19)7-11/h3-10H,1-2H3,(H2,21,22,23,24)