2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-1-piperidino-ethanone Formula: C11H16N4O3S MolecularWeight: 284.33474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O3S/c1-8-10(15(17)18)11(13-12-8)19-7-9(16)14-5-3-2-4-6-14/h2-7H2,1H3,(H,12,13)