N6-propyl-N4-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-propyl-N4-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N6-propyl-N4-(3-pyridylmethyl)pyrimidine-4,5,6-triamine CAS Name: N6-propyl-N4-(3-pyridinylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-propyl-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(propylamino)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C13H18N6 MolecularWeight: 258.32222

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC(=C1N)NCC2=CN=CC=C2

Isomeric SMILES

CCCNC1=NC=NC(=C1N)NCC2=CN=CC=C2

InChI

InChI=1S/C13H18N6/c1-2-5-16-12-11(14)13(19-9-18-12)17-8-10-4-3-6-15-7-10/h3-4,6-7,9H,2,5,8,14H2,1H3,(H2,16,17,18,19)