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

Systemtic Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-1-pyrrolidino-ethanone Formula: C10H14N4O3S MolecularWeight: 270.30816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N4O3S/c1-7-9(14(16)17)10(12-11-7)18-6-8(15)13-4-2-3-5-13/h2-6H2,1H3,(H,11,12)