N-methyl-6-(3-methylpiperidin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: N-methyl-6-(3-methylpiperidin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: N-benzyl-N-methyl-6-(3-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: N-methyl-6-(3-methyl-1-piperidinyl)-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: N-benzyl-N-methyl-6-(3-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: benzyl-methyl-[6-(3-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NC=N2)N(C)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C(=NC=N2)N(C)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O2/c1-14-7-6-10-22(11-14)18-16(23(24)25)17(19-13-20-18)21(2)12-15-8-4-3-5-9-15/h3-5,8-9,13-14H,6-7,10-12H2,1-2H3