ethyl 2-[2-[(2S)-2-acetamido-4-methylsulfanyl-butanoyl]oxyethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(2S)-2-acetamido-4-methylsulfanyl-butanoyl]oxyethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(2S)-2-acetamido-4-methylsulfanyl-butanoyl]oxyacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-[(2S)-2-acetamido-4-(methylthio)-1-oxobutoxy]-1-oxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2S)-2-acetamido-4-methylsulfanylbutanoyl]oxyacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-[(2S)-2-acetamido-4-(methylthio)butanoyl]oxyacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C19H26N2O6S2 MolecularWeight: 442.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)COC(=O)C(CCSC)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)COC(=O)[C@H](CCSC)NC(=O)C

InChI

InChI=1S/C19H26N2O6S2/c1-4-26-19(25)16-12-6-5-7-14(12)29-17(16)21-15(23)10-27-18(24)13(8-9-28-3)20-11(2)22/h13H,4-10H2,1-3H3,(H,20,22)(H,21,23)/t13-/m0/s1