methyl 2-[2-(2-hydroxyethylsulfanyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2-hydroxyethylsulfanyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2-hydroxyethylsulfanyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-(2-hydroxyethylthio)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-hydroxyethylsulfanyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(2-hydroxyethylthio)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C14H19NO4S2 MolecularWeight: 329.43496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSCCO

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSCCO

InChI

InChI=1S/C14H19NO4S2/c1-19-14(18)12-9-4-2-3-5-10(9)21-13(12)15-11(17)8-20-7-6-16/h16H,2-8H2,1H3,(H,15,17)