6-(4-methylpiperidin-1-yl)-5-nitro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine

Systemtic Name: 6-(4-methylpiperidin-1-yl)-5-nitro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine Openeye Name: 6-(4-methyl-1-piperidyl)-5-nitro-N-(3-pyridylmethyl)pyrimidin-4-amine CAS Name: 6-(4-methyl-1-piperidinyl)-5-nitro-N-(3-pyridinylmethyl)-4-pyrimidinamine IUPAC Name: 6-(4-methylpiperidin-1-yl)-5-nitro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine Traditional Name: [6-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C16H20N6O2 MolecularWeight: 328.369

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NC=N2)NCC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NC=N2)NCC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N6O2/c1-12-4-7-21(8-5-12)16-14(22(23)24)15(19-11-20-16)18-10-13-3-2-6-17-9-13/h2-3,6,9,11-12H,4-5,7-8,10H2,1H3,(H,18,19,20)