(2S)-1-(3-ethanoylsulfanylpropanoyl)-4-(thiophen-2-ylmethyl)-2,5-dihydropyrrole-2-carboxylic acid

Systemtic Name: (2S)-1-(3-ethanoylsulfanylpropanoyl)-4-(thiophen-2-ylmethyl)-2,5-dihydropyrrole-2-carboxylic acid Openeye Name: (2S)-1-(3-acetylsulfanylpropanoyl)-4-(2-thienylmethyl)-2,5-dihydropyrrole-2-carboxylic acid CAS Name: (2S)-1-[3-(acetylthio)-1-oxopropyl]-4-(thiophen-2-ylmethyl)-2,5-dihydropyrrole-2-carboxylic acid IUPAC Name: (2S)-1-(3-acetylsulfanylpropanoyl)-4-(thiophen-2-ylmethyl)-2,5-dihydropyrrole-2-carboxylic acid Traditional Name: (2S)-1-[3-(acetylthio)propanoyl]-4-(2-thenyl)-3-pyrroline-2-carboxylic acid Formula: C15H17NO4S2 MolecularWeight: 339.42978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(=O)N1CC(=CC1C(=O)O)CC2=CC=CS2

Isomeric SMILES

CC(=O)SCCC(=O)N1CC(=C[C@H]1C(=O)O)CC2=CC=CS2

InChI

InChI=1S/C15H17NO4S2/c1-10(17)21-6-4-14(18)16-9-11(8-13(16)15(19)20)7-12-3-2-5-22-12/h2-3,5,8,13H,4,6-7,9H2,1H3,(H,19,20)/t13-/m0/s1