2-[(2-ethyl-4-oxidanylidene-3-sulfanyl-4-thiophen-2-yl-butanoyl)amino]-4-sulfanyl-butanoic acid

Systemtic Name: 2-[(2-ethyl-4-oxidanylidene-3-sulfanyl-4-thiophen-2-yl-butanoyl)amino]-4-sulfanyl-butanoic acid Openeye Name: 2-[[2-ethyl-4-oxo-3-sulfanyl-4-(2-thienyl)butanoyl]amino]-4-sulfanyl-butanoic acid CAS Name: 2-[(2-ethyl-3-mercapto-1,4-dioxo-4-thiophen-2-ylbutyl)amino]-4-mercaptobutanoic acid IUPAC Name: 2-[(2-ethyl-4-oxo-3-sulfanyl-4-thiophen-2-ylbutanoyl)amino]-4-sulfanylbutanoic acid Traditional Name: 2-[[2-ethyl-4-keto-3-mercapto-4-(2-thienyl)butanoyl]amino]-4-mercapto-butyric acid Formula: C14H19NO4S3 MolecularWeight: 361.49996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(=O)C1=CC=CS1)S)C(=O)NC(CCS)C(=O)O

Isomeric SMILES

CCC(C(C(=O)C1=CC=CS1)S)C(=O)NC(CCS)C(=O)O

InChI

InChI=1S/C14H19NO4S3/c1-2-8(12(21)11(16)10-4-3-7-22-10)13(17)15-9(5-6-20)14(18)19/h3-4,7-9,12,20-21H,2,5-6H2,1H3,(H,15,17)(H,18,19)