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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC(=C(C(=C3)C)Cl)C)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC(=C(C(=C3)C)Cl)C)N)C

InChI

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