(2-cyano-4-nitro-phenyl) N,N-diethylcarbamodithioate

Systemtic Name: (2-cyano-4-nitro-phenyl) N,N-diethylcarbamodithioate Openeye Name: (2-cyano-4-nitro-phenyl) N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid (2-cyano-4-nitrophenyl) ester IUPAC Name: (2-cyano-4-nitrophenyl) N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (2-cyano-4-nitro-phenyl) ester Formula: C12H13N3O2S2 MolecularWeight: 295.38052

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CCN(CC)C(=S)SC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H13N3O2S2/c1-3-14(4-2)12(18)19-11-6-5-10(15(16)17)7-9(11)8-13/h5-7H,3-4H2,1-2H3