5-nitro-N4-(oxolan-2-ylmethyl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(oxolan-2-ylmethyl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-(3-pyridylmethyl)-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(2-oxolanylmethyl)-N6-(3-pyridinylmethyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(oxolan-2-ylmethyl)-6-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C15H18N6O3 MolecularWeight: 330.34182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CN=CC=C3

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CN=CC=C3

InChI

InChI=1S/C15H18N6O3/c22-21(23)13-14(17-8-11-3-1-5-16-7-11)19-10-20-15(13)18-9-12-4-2-6-24-12/h1,3,5,7,10,12H,2,4,6,8-9H2,(H2,17,18,19,20)