[2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-[(2-cyano-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-(2-cyano-4-nitro-anilino)-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-(2-cyano-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyano-4-nitroanilino)-2-oxoethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-(2-cyano-4-nitro-anilino)-2-keto-ethyl] ester Formula: C12H12N4O3S2 MolecularWeight: 324.37868

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CN(C)C(=S)SCC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H12N4O3S2/c1-15(2)12(20)21-7-11(17)14-10-4-3-9(16(18)19)5-8(10)6-13/h3-5H,7H2,1-2H3,(H,14,17)