methyl 4,5-dimethyl-2-[2-(3-phenylsulfanylpropanoyloxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-(3-phenylsulfanylpropanoyloxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-(3-phenylsulfanylpropanoyloxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-[1-oxo-3-(phenylthio)propoxy]ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(3-phenylsulfanylpropanoyloxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[3-(phenylthio)propanoyloxy]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CCSC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CCSC2=CC=CC=C2)C

InChI

InChI=1S/C19H21NO5S2/c1-12-13(2)27-18(17(12)19(23)24-3)20-15(21)11-25-16(22)9-10-26-14-7-5-4-6-8-14/h4-8H,9-11H2,1-3H3,(H,20,21)