(2S)-4-methoxy-1-(2-methyl-3-sulfanyl-propanoyl)-2,5-dihydropyrrole-2-carboxylic acid

Systemtic Name: (2S)-4-methoxy-1-(2-methyl-3-sulfanyl-propanoyl)-2,5-dihydropyrrole-2-carboxylic acid Openeye Name: (2S)-4-methoxy-1-(2-methyl-3-sulfanyl-propanoyl)-2,5-dihydropyrrole-2-carboxylic acid CAS Name: (2S)-1-(3-mercapto-2-methyl-1-oxopropyl)-4-methoxy-2,5-dihydropyrrole-2-carboxylic acid IUPAC Name: (2S)-4-methoxy-1-(2-methyl-3-sulfanylpropanoyl)-2,5-dihydropyrrole-2-carboxylic acid Traditional Name: (2S)-1-(3-mercapto-2-methyl-propanoyl)-4-methoxy-3-pyrroline-2-carboxylic acid Formula: C10H15NO4S MolecularWeight: 245.2954

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CC(=CC1C(=O)O)OC

Isomeric SMILES

CC(CS)C(=O)N1CC(=C[C@H]1C(=O)O)OC

InChI

InChI=1S/C10H15NO4S/c1-6(5-16)9(12)11-4-7(15-2)3-8(11)10(13)14/h3,6,8,16H,4-5H2,1-2H3,(H,13,14)/t6?,8-/m0/s1