[2-[(2-chloranyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-[(2-chloranyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-(2-chloro-4-thiocyanato-anilino)-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-(2-chloro-4-thiocyanatoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-thiocyanatoanilino)-2-oxoethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-(2-chloro-4-thiocyanato-anilino)-2-keto-ethyl] ester Formula: C12H12ClN3OS3 MolecularWeight: 345.89118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)NC1=C(C=C(C=C1)SC#N)Cl

Isomeric SMILES

CN(C)C(=S)SCC(=O)NC1=C(C=C(C=C1)SC#N)Cl

InChI

InChI=1S/C12H12ClN3OS3/c1-16(2)12(18)19-6-11(17)15-10-4-3-8(20-7-14)5-9(10)13/h3-5H,6H2,1-2H3,(H,15,17)