6-(2-methylpiperidin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: 6-(2-methylpiperidin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: N-benzyl-6-(2-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(2-methyl-1-piperidinyl)-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: N-benzyl-6-(2-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: benzyl-[6-(2-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1C2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O2/c1-13-7-5-6-10-21(13)17-15(22(23)24)16(19-12-20-17)18-11-14-8-3-2-4-9-14/h2-4,8-9,12-13H,5-7,10-11H2,1H3,(H,18,19,20)