[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 3-methoxynaphthalene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 3-methoxynaphthalene-2-carboxylate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 3-methoxynaphthalene-2-carboxylate CAS Name: 3-methoxy-2-naphthalenecarboxylic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 3-methoxynaphthalene-2-carboxylate Traditional Name: 3-methoxynaphthalene-2-carboxylic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)OCC(=O)NCCSCC3=CC=CS3

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)OCC(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C21H21NO4S2/c1-25-19-12-16-6-3-2-5-15(16)11-18(19)21(24)26-13-20(23)22-8-10-27-14-17-7-4-9-28-17/h2-7,9,11-12H,8,10,13-14H2,1H3,(H,22,23)