1-[4-(butylamino)-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(butylamino)-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(butylamino)-4-oxo-2-(sulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[4-(butylamino)-2-(mercaptomethyl)-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(butylamino)-4-oxo-2-(sulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(butylamino)-4-keto-2-(mercaptomethyl)butanoyl]proline Formula: C14H24N2O4S MolecularWeight: 316.41636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC(CS)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CCCCNC(=O)CC(CS)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C14H24N2O4S/c1-2-3-6-15-12(17)8-10(9-21)13(18)16-7-4-5-11(16)14(19)20/h10-11,21H,2-9H2,1H3,(H,15,17)(H,19,20)