N6-(4-butylphenyl)-N4-(3-methylpyridin-2-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(4-butylphenyl)-N4-(3-methylpyridin-2-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butylphenyl)-N4-(3-methyl-2-pyridyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-butylphenyl)-N4-(3-methyl-2-pyridinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-butylphenyl)-4-N-(3-methylpyridin-2-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-(3-methyl-2-pyridyl)amine Formula: C20H24N6 MolecularWeight: 348.44476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=C(C=CC=N3)C)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=C(C=CC=N3)C)N

InChI

InChI=1S/C20H24N6/c1-3-4-7-15-8-10-16(11-9-15)25-19-17(21)20(24-13-23-19)26-18-14(2)6-5-12-22-18/h5-6,8-13H,3-4,7,21H2,1-2H3,(H2,22,23,24,25,26)