2-(5-nitropyridin-2-yl)sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-(5-nitropyridin-2-yl)sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[(5-nitro-2-pyridyl)sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[(5-nitro-2-pyridinyl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(5-nitropyridin-2-yl)sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(5-nitro-2-pyridyl)thio]-1-piperidino-ethanone Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O3S/c16-12(14-6-2-1-3-7-14)9-19-11-5-4-10(8-13-11)15(17)18/h4-5,8H,1-3,6-7,9H2