N6-(4-butoxyphenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-butoxyphenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butoxyphenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-butoxyphenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-butoxyphenyl)-4-N-(3-methoxyphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butoxyanilino)pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC(=CC=C3)OC)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC(=CC=C3)OC)N

InChI

InChI=1S/C21H25N5O2/c1-3-4-12-28-17-10-8-15(9-11-17)25-20-19(22)21(24-14-23-20)26-16-6-5-7-18(13-16)27-2/h5-11,13-14H,3-4,12,22H2,1-2H3,(H2,23,24,25,26)