1-[2-[[1-ethoxy-1,6-bis(oxidanylidene)-6-thiophen-2-yl-hexan-2-yl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[1-ethoxy-1,6-bis(oxidanylidene)-6-thiophen-2-yl-hexan-2-yl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[1-ethoxycarbonyl-5-oxo-5-(2-thienyl)pentyl]amino]-5-hydroxy-5-oxo-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(1-ethoxy-1,6-dioxo-6-thiophen-2-ylhexan-2-yl)amino]-5-hydroxy-1,5-dioxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(1-ethoxy-1,6-dioxo-6-thiophen-2-ylhexan-2-yl)amino]-5-hydroxy-5-oxopentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[1-carbethoxy-5-keto-5-(2-thienyl)pentyl]amino]-5-hydroxy-5-keto-pentanoyl]proline Formula: C22H30N2O8S MolecularWeight: 482.5472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC(=O)C1=CC=CS1)NC(CCC(=O)O)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCOC(=O)C(CCCC(=O)C1=CC=CS1)NC(CCC(=O)O)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C22H30N2O8S/c1-2-32-22(31)15(6-3-8-17(25)18-9-5-13-33-18)23-14(10-11-19(26)27)20(28)24-12-4-7-16(24)21(29)30/h5,9,13-16,23H,2-4,6-8,10-12H2,1H3,(H,26,27)(H,29,30)