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N6-(1,3-benzodioxol-5-ylmethyl)-N4-cyclopentyl-5-nitro-pyrimidine-4,6-diamine

N6-(1,3-benzodioxol-5-ylmethyl)-N4-cyclopentyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name:N6-(1,3-benzodioxol-5-ylmethyl)-N4-cyclopentyl-5-nitro-pyrimidine-4,6-diamine
Openeye Name:N6-(1,3-benzodioxol-5-ylmethyl)-N4-cyclopentyl-5-nitro-pyrimidine-4,6-diamine
CAS Name:N6-(1,3-benzodioxol-5-ylmethyl)-N4-cyclopentyl-5-nitropyrimidine-4,6-diamine
IUPAC Name:6-N-(1,3-benzodioxol-5-ylmethyl)-4-N-cyclopentyl-5-nitropyrimidine-4,6-diamine
Traditional Name:cyclopentyl-[5-nitro-6-(piperonylamino)pyrimidin-4-yl]amine
Formula: C17H19N5O4
MolecularWeight: 357.36386
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]


Isomeric SMILES

C1CCC(C1)NC2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]


InChI

InChI=1S/C17H19N5O4/c23-22(24)15-16(19-9-20-17(15)21-12-3-1-2-4-12)18-8-11-5-6-13-14(7-11)26-10-25-13/h5-7,9,12H,1-4,8,10H2,(H2,18,19,20,21)


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