2-[[1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidin-2-yl]carbonylamino]butanedioic acid

Systemtic Name: 2-[[1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidin-2-yl]carbonylamino]butanedioic acid Openeye Name: 2-[[1-(3-acetylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carbonyl]amino]butanedioic acid CAS Name: 2-[[[1-[3-(acetylthio)-2-methyl-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]butanedioic acid IUPAC Name: 2-[[1-(3-acetylsulfanyl-2-methylpropanoyl)pyrrolidine-2-carbonyl]amino]butanedioic acid Traditional Name: 2-[[1-[3-(acetylthio)-2-methyl-propanoyl]prolyl]amino]succinic acid Formula: C15H22N2O7S MolecularWeight: 374.40938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CCCC1C(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CCCC1C(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C15H22N2O7S/c1-8(7-25-9(2)18)14(22)17-5-3-4-11(17)13(21)16-10(15(23)24)6-12(19)20/h8,10-11H,3-7H2,1-2H3,(H,16,21)(H,19,20)(H,23,24)