N4-(3,5-dimethylphenyl)-6-(4-propan-2-ylphenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(3,5-dimethylphenyl)-6-(4-propan-2-ylphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(3,5-dimethylphenyl)-6-(4-isopropylphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(3,5-dimethylphenyl)-6-(4-propan-2-ylphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-(4-propan-2-ylphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-isopropylphenoxy)pyrimidin-4-yl]-(3,5-dimethylphenyl)amine Formula: C21H24N4O MolecularWeight: 348.44146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O/c1-13(2)16-5-7-18(8-6-16)26-21-19(22)20(23-12-24-21)25-17-10-14(3)9-15(4)11-17/h5-13H,22H2,1-4H3,(H,23,24,25)