[2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-(2-benzoyl-4-chloro-anilino)-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-(2-benzoyl-4-chloro-anilino)-2-keto-ethyl] ester Formula: C20H21ClN2O2S2 MolecularWeight: 420.97594

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21ClN2O2S2/c1-3-23(4-2)20(26)27-13-18(24)22-17-11-10-15(21)12-16(17)19(25)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H,22,24)