N4-(1,3-benzodioxol-5-ylmethyl)-N6-prop-2-enyl-pyrimidine-4,5,6-triamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-N6-prop-2-enyl-pyrimidine-4,5,6-triamine Openeye Name: N6-allyl-N4-(1,3-benzodioxol-5-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-N6-prop-2-enylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-N-prop-2-enylpyrimidine-4,5,6-triamine Traditional Name: allyl-[5-amino-6-(piperonylamino)pyrimidin-4-yl]amine Formula: C15H17N5O2 MolecularWeight: 299.32778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC=NC(=C1N)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C=CCNC1=NC=NC(=C1N)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H17N5O2/c1-2-5-17-14-13(16)15(20-8-19-14)18-7-10-3-4-11-12(6-10)22-9-21-11/h2-4,6,8H,1,5,7,9,16H2,(H2,17,18,19,20)