methyl (2S)-2-[(5-ethanoylthiophen-2-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[(5-ethanoylthiophen-2-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[(5-acetylthiophene-2-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(5-acetyl-2-thiophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(5-acetylthiophene-2-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(5-acetylthiophene-2-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C13H17NO4S2 MolecularWeight: 315.40838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N[C@@H](CCSC)C(=O)OC

InChI

InChI=1S/C13H17NO4S2/c1-8(15)10-4-5-11(20-10)12(16)14-9(6-7-19-3)13(17)18-2/h4-5,9H,6-7H2,1-3H3,(H,14,16)/t9-/m0/s1