[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methoxy-2-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methoxy-2-oxidanyl-benzoate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 2-hydroxy-4-methoxy-benzoate CAS Name: 2-hydroxy-4-methoxybenzoic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 2-hydroxy-4-methoxybenzoate Traditional Name: 2-hydroxy-4-methoxy-benzoic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C17H19NO5S2 MolecularWeight: 381.46646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO5S2/c1-22-12-4-5-14(15(19)9-12)17(21)23-10-16(20)18-6-8-24-11-13-3-2-7-25-13/h2-5,7,9,19H,6,8,10-11H2,1H3,(H,18,20)