(2S,4S)-2-[[(5-ethoxycarbonylthiophen-2-yl)carbonylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylic acid

Systemtic Name: (2S,4S)-2-[[(5-ethoxycarbonylthiophen-2-yl)carbonylamino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylic acid Openeye Name: (2S,4S)-2-[[(5-ethoxycarbonylthiophene-2-carbonyl)amino]methyl]-4-sulfanyl-pyrrolidine-1-carboxylic acid CAS Name: (2S,4S)-2-[[[(5-ethoxycarbonyl-2-thiophenyl)-oxomethyl]amino]methyl]-4-mercapto-1-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-2-[[(5-ethoxycarbonylthiophene-2-carbonyl)amino]methyl]-4-sulfanylpyrrolidine-1-carboxylic acid Traditional Name: (2S,4S)-2-[[(5-carbethoxythiophene-2-carbonyl)amino]methyl]-4-mercapto-pyrrolidine-1-carboxylic acid Formula: C14H18N2O5S2 MolecularWeight: 358.43312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(S1)C(=O)NCC2CC(CN2C(=O)O)S

Isomeric SMILES

CCOC(=O)C1=CC=C(S1)C(=O)NC[C@@H]2C[C@@H](CN2C(=O)O)S

InChI

InChI=1S/C14H18N2O5S2/c1-2-21-13(18)11-4-3-10(23-11)12(17)15-6-8-5-9(22)7-16(8)14(19)20/h3-4,8-9,22H,2,5-7H2,1H3,(H,15,17)(H,19,20)/t8-,9-/m0/s1