6-(3,5-dimethylphenoxy)-N4-phenyl-pyrimidine-4,5-diamine

Systemtic Name: 6-(3,5-dimethylphenoxy)-N4-phenyl-pyrimidine-4,5-diamine Openeye Name: 6-(3,5-dimethylphenoxy)-N4-phenyl-pyrimidine-4,5-diamine CAS Name: 6-(3,5-dimethylphenoxy)-N4-phenylpyrimidine-4,5-diamine IUPAC Name: 6-(3,5-dimethylphenoxy)-4-N-phenylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]-phenyl-amine Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=CC=CC=C3)C

InChI

InChI=1S/C18H18N4O/c1-12-8-13(2)10-15(9-12)23-18-16(19)17(20-11-21-18)22-14-6-4-3-5-7-14/h3-11H,19H2,1-2H3,(H,20,21,22)