[2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylmethylsulfanyl)benzoate

Systemtic Name: [2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylmethylsulfanyl)benzoate Openeye Name: [2-[[2-(methylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl] 2-(2-thienylmethylsulfanyl)benzoate CAS Name: 2-(thiophen-2-ylmethylthio)benzoic acid [2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl] 2-(thiophen-2-ylmethylsulfanyl)benzoate Traditional Name: 2-(2-thenylthio)benzoic acid [2-keto-2-[[2-keto-2-(methylamino)ethyl]amino]ethyl] ester Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)COC(=O)C1=CC=CC=C1SCC2=CC=CS2

Isomeric SMILES

CNC(=O)CNC(=O)COC(=O)C1=CC=CC=C1SCC2=CC=CS2

InChI

InChI=1S/C17H18N2O4S2/c1-18-15(20)9-19-16(21)10-23-17(22)13-6-2-3-7-14(13)25-11-12-5-4-8-24-12/h2-8H,9-11H2,1H3,(H,18,20)(H,19,21)