piperidin-1-ylsulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate

Systemtic Name: piperidin-1-ylsulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate Openeye Name: 1-piperidylsulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate CAS Name: 1-cyano-N-(4-nitrophenyl)methanimidothioic acid (1-piperidinylthio) ester IUPAC Name: piperidin-1-ylsulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate Traditional Name: 1-cyano-N-(4-nitrophenyl)thioformimidic acid (piperidinothio) ester Formula: C13H14N4O2S2 MolecularWeight: 322.40586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)SSC(=NC2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCN(CC1)SSC(=NC2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H14N4O2S2/c14-10-13(20-21-16-8-2-1-3-9-16)15-11-4-6-12(7-5-11)17(18)19/h4-7H,1-3,8-9H2