diethylaminosulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate

Systemtic Name: diethylaminosulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate Openeye Name: diethylaminosulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate CAS Name: 1-cyano-N-(4-nitrophenyl)methanimidothioic acid (diethylaminothio) ester IUPAC Name: diethylaminosulfanyl 1-cyano-N-(4-nitrophenyl)methanimidothioate Traditional Name: 1-cyano-N-(4-nitrophenyl)thioformimidic acid (diethylaminothio) ester Formula: C12H14N4O2S2 MolecularWeight: 310.39516

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)SSC(=NC1=CC=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CCN(CC)SSC(=NC1=CC=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H14N4O2S2/c1-3-15(4-2)20-19-12(9-13)14-10-5-7-11(8-6-10)16(17)18/h5-8H,3-4H2,1-2H3