N6-(4-ethylphenyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-ethylphenyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-ethylphenyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-ethylphenyl)-N4-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-ethylphenyl)-4-N-(4-phenoxyphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-ethylanilino)pyrimidin-4-yl]-(4-phenoxyphenyl)amine Formula: C24H23N5O MolecularWeight: 397.47232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)OC4=CC=CC=C4)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)OC4=CC=CC=C4)N

InChI

InChI=1S/C24H23N5O/c1-2-17-8-10-18(11-9-17)28-23-22(25)24(27-16-26-23)29-19-12-14-21(15-13-19)30-20-6-4-3-5-7-20/h3-16H,2,25H2,1H3,(H2,26,27,28,29)