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

Systemtic Name: N4-butan-2-yl-N6-(4-butylphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-butylphenyl)-N4-sec-butyl-pyrimidine-4,5,6-triamine CAS Name: N4-butan-2-yl-N6-(4-butylphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-butan-2-yl-6-N-(4-butylphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-butylanilino)pyrimidin-4-yl]-sec-butyl-amine Formula: C18H27N5 MolecularWeight: 313.44048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N5/c1-4-6-7-14-8-10-15(11-9-14)23-18-16(19)17(20-12-21-18)22-13(3)5-2/h8-13H,4-7,19H2,1-3H3,(H2,20,21,22,23)