6-(4-chloranyl-3,5-dimethyl-phenoxy)-N4-(2-ethylphenyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-N4-(2-ethylphenyl)pyrimidine-4,5-diamine Openeye Name: 6-(4-chloro-3,5-dimethyl-phenoxy)-N4-(2-ethylphenyl)pyrimidine-4,5-diamine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-N4-(2-ethylphenyl)pyrimidine-4,5-diamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-4-N-(2-ethylphenyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-chloro-3,5-dimethyl-phenoxy)pyrimidin-4-yl]-(2-ethylphenyl)amine Formula: C20H21ClN4O MolecularWeight: 368.85994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)OC3=CC(=C(C(=C3)C)Cl)C)N

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)OC3=CC(=C(C(=C3)C)Cl)C)N

InChI

InChI=1S/C20H21ClN4O/c1-4-14-7-5-6-8-16(14)25-19-18(22)20(24-11-23-19)26-15-9-12(2)17(21)13(3)10-15/h5-11H,4,22H2,1-3H3,(H,23,24,25)