5-nitro-N4-(oxolan-2-ylmethyl)-N6-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(oxolan-2-ylmethyl)-N6-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-[2-(1-piperidyl)ethyl]-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(2-oxolanylmethyl)-N6-[2-(1-piperidinyl)ethyl]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(oxolan-2-ylmethyl)-6-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C16H26N6O3 MolecularWeight: 350.41604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

Isomeric SMILES

C1CCN(CC1)CCNC2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

InChI

InChI=1S/C16H26N6O3/c23-22(24)14-15(17-6-9-21-7-2-1-3-8-21)19-12-20-16(14)18-11-13-5-4-10-25-13/h12-13H,1-11H2,(H2,17,18,19,20)