[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 5-chloranyl-2-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 5-chloranyl-2-methoxy-benzoate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 5-chloro-2-methoxy-benzoate CAS Name: 5-chloro-2-methoxybenzoic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 5-chloro-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-benzoic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C17H18ClNO4S2 MolecularWeight: 399.91212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)OCC(=O)NCCSCC2=CC=CS2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)OCC(=O)NCCSCC2=CC=CS2

InChI

InChI=1S/C17H18ClNO4S2/c1-22-15-5-4-12(18)9-14(15)17(21)23-10-16(20)19-6-8-24-11-13-3-2-7-25-13/h2-5,7,9H,6,8,10-11H2,1H3,(H,19,20)