1-[2-(2-nitrothiophen-3-yl)sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(2-nitrothiophen-3-yl)sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(2-nitro-3-thienyl)sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(2-nitro-3-thiophenyl)thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(2-nitrothiophen-3-yl)sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(2-nitro-3-thienyl)thio]acetyl]isonipecotamide Formula: C12H15N3O4S2 MolecularWeight: 329.3952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CSC2=C(SC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CSC2=C(SC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O4S2/c13-11(17)8-1-4-14(5-2-8)10(16)7-21-9-3-6-20-12(9)15(18)19/h3,6,8H,1-2,4-5,7H2,(H2,13,17)