[(E)-2-cyano-1-(3-nitrophenyl)ethenyl] N,N-diethylcarbamodithioate

Systemtic Name: [(E)-2-cyano-1-(3-nitrophenyl)ethenyl] N,N-diethylcarbamodithioate Openeye Name: [(E)-2-cyano-1-(3-nitrophenyl)vinyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [(E)-2-cyano-1-(3-nitrophenyl)ethenyl] ester IUPAC Name: [(E)-2-cyano-1-(3-nitrophenyl)ethenyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [(E)-2-cyano-1-(3-nitrophenyl)vinyl] ester Formula: C14H15N3O2S2 MolecularWeight: 321.4178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O2S2/c1-3-16(4-2)14(20)21-13(8-9-15)11-6-5-7-12(10-11)17(18)19/h5-8,10H,3-4H2,1-2H3/b13-8+