2-[[1-[2-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-5-thiophen-2-yl-pentanoic acid

Systemtic Name: 2-[[1-[2-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-5-thiophen-2-yl-pentanoic acid Openeye Name: 2-[[2-(2-tert-butoxycarbonylpyrrolidin-1-yl)-1-methyl-2-oxo-ethyl]amino]-5-oxo-5-(2-thienyl)pentanoic acid CAS Name: 2-[[1-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-pyrrolidinyl]-1-oxopropan-2-yl]amino]-5-oxo-5-thiophen-2-ylpentanoic acid IUPAC Name: 2-[[1-[2-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-5-oxo-5-thiophen-2-ylpentanoic acid Traditional Name: 2-[[2-(2-tert-butoxycarbonylpyrrolidino)-2-keto-1-methyl-ethyl]amino]-5-keto-5-(2-thienyl)valeric acid Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)OC(C)(C)C)NC(CCC(=O)C2=CC=CS2)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)OC(C)(C)C)NC(CCC(=O)C2=CC=CS2)C(=O)O

InChI

InChI=1S/C21H30N2O6S/c1-13(18(25)23-11-5-7-15(23)20(28)29-21(2,3)4)22-14(19(26)27)9-10-16(24)17-8-6-12-30-17/h6,8,12-15,22H,5,7,9-11H2,1-4H3,(H,26,27)