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

Systemtic Name: N4-(4-butoxyphenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-butoxyphenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine CAS Name: N4-(4-butoxyphenyl)-N6-(4-ethylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-butoxyphenyl)-6-N-(4-ethylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butoxyanilino)pyrimidin-4-yl]-(4-ethylphenyl)amine Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)CC

InChI

InChI=1S/C22H27N5O/c1-3-5-14-28-19-12-10-18(11-13-19)27-22-20(23)21(24-15-25-22)26-17-8-6-16(4-2)7-9-17/h6-13,15H,3-5,14,23H2,1-2H3,(H2,24,25,26,27)