ethyl 5-[2-(phenylsulfonyl)ethylsulfanyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(phenylsulfonyl)ethylsulfanyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 5-[2-(benzenesulfonyl)ethylsulfanyl]thiazole-4-carboxylate CAS Name: 5-[2-(benzenesulfonyl)ethylthio]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(benzenesulfonyl)ethylsulfanyl]-1,3-thiazole-4-carboxylate Traditional Name: 5-(2-besylethylthio)thiazole-4-carboxylic acid ethyl ester Formula: C14H15NO4S3 MolecularWeight: 357.4682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=N1)SCCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC=N1)SCCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H15NO4S3/c1-2-19-13(16)12-14(21-10-15-12)20-8-9-22(17,18)11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3