N4-(3,5-dimethylphenyl)-N6-(3-methylbutyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(3,5-dimethylphenyl)-N6-(3-methylbutyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(3,5-dimethylphenyl)-N6-isopentyl-pyrimidine-4,5,6-triamine CAS Name: N4-(3,5-dimethylphenyl)-N6-(3-methylbutyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-N-(3-methylbutyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]-isoamyl-amine Formula: C17H25N5 MolecularWeight: 299.4139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NCCC(C)C)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NCCC(C)C)N)C

InChI

InChI=1S/C17H25N5/c1-11(2)5-6-19-16-15(18)17(21-10-20-16)22-14-8-12(3)7-13(4)9-14/h7-11H,5-6,18H2,1-4H3,(H2,19,20,21,22)