1-(4-methylpiperidin-1-yl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperidin-1-yl)-2-(5-nitropyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-methyl-1-piperidyl)-2-[(5-nitro-2-pyridyl)sulfanyl]ethanone CAS Name: 1-(4-methyl-1-piperidinyl)-2-[(5-nitro-2-pyridinyl)thio]ethanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-2-(5-nitropyridin-2-yl)sulfanylethanone Traditional Name: 1-(4-methylpiperidino)-2-[(5-nitro-2-pyridyl)thio]ethanone Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3S/c1-10-4-6-15(7-5-10)13(17)9-20-12-3-2-11(8-14-12)16(18)19/h2-3,8,10H,4-7,9H2,1H3