N6-(1,3-benzodioxol-5-ylmethyl)-N4-tert-butyl-pyrimidine-4,5,6-triamine

Systemtic Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-tert-butyl-pyrimidine-4,5,6-triamine Openeye Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-tert-butyl-pyrimidine-4,5,6-triamine CAS Name: N6-(1,3-benzodioxol-5-ylmethyl)-N4-tert-butylpyrimidine-4,5,6-triamine IUPAC Name: 6-N-(1,3-benzodioxol-5-ylmethyl)-4-N-tert-butylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(tert-butylamino)pyrimidin-4-yl]-piperonyl-amine Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1N)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1N)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H21N5O2/c1-16(2,3)21-15-13(17)14(19-8-20-15)18-7-10-4-5-11-12(6-10)23-9-22-11/h4-6,8H,7,9,17H2,1-3H3,(H2,18,19,20,21)