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

Systemtic Name: 5-nitro-N4-propan-2-yl-N6-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-5-nitro-N6-(3-pyridylmethyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-propan-2-yl-N6-(3-pyridinylmethyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-propan-2-yl-6-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Traditional Name: isopropyl-[5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]amine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCC2=CN=CC=C2

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCC2=CN=CC=C2

InChI

InChI=1S/C13H16N6O2/c1-9(2)18-13-11(19(20)21)12(16-8-17-13)15-7-10-4-3-5-14-6-10/h3-6,8-9H,7H2,1-2H3,(H2,15,16,17,18)