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

Systemtic Name: [2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-(4-methoxy-2-nitro-anilino)-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-(4-methoxy-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxy-2-nitroanilino)-2-oxoethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-keto-2-(4-methoxy-2-nitro-anilino)ethyl] ester Formula: C12H15N3O4S2 MolecularWeight: 329.3952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O4S2/c1-14(2)12(20)21-7-11(16)13-9-5-4-8(19-3)6-10(9)15(17)18/h4-6H,7H2,1-3H3,(H,13,16)