ethyl 4-ethyl-5-methyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-benzylsulfanylacetyl)amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzylsulfanylacetyl)amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(benzylthio)acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H23NO3S2 MolecularWeight: 377.52082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CSCC2=CC=CC=C2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CSCC2=CC=CC=C2)C

InChI

InChI=1S/C19H23NO3S2/c1-4-15-13(3)25-18(17(15)19(22)23-5-2)20-16(21)12-24-11-14-9-7-6-8-10-14/h6-10H,4-5,11-12H2,1-3H3,(H,20,21)