3-methyl-2-[[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[2-oxo-2-[2-(2-thienyl)pyrrolidin-1-yl]ethyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-oxo-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]amino]butanoic acid Traditional Name: 2-[[2-keto-2-[2-(2-thienyl)pyrrolidino]ethyl]amino]-3-methyl-butyric acid Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)N1CCCC1C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)N1CCCC1C2=CC=CS2

InChI

InChI=1S/C15H22N2O3S/c1-10(2)14(15(19)20)16-9-13(18)17-7-3-5-11(17)12-6-4-8-21-12/h4,6,8,10-11,14,16H,3,5,7,9H2,1-2H3,(H,19,20)