N4-(4-butylphenyl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(4-butylphenyl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(4-butylphenyl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(4-butylphenyl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(4-butylphenyl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(2-methoxyphenoxy)pyrimidin-4-yl]-(4-butylphenyl)amine Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3=CC=CC=C3OC)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3=CC=CC=C3OC)N

InChI

InChI=1S/C21H24N4O2/c1-3-4-7-15-10-12-16(13-11-15)25-20-19(22)21(24-14-23-20)27-18-9-6-5-8-17(18)26-2/h5-6,8-14H,3-4,7,22H2,1-2H3,(H,23,24,25)