(2S)-1-[(2R)-3-methyl-2-(propan-2-yloxycarbonylamino)-3-propan-2-ylsulfanyl-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-3-methyl-2-(propan-2-yloxycarbonylamino)-3-propan-2-ylsulfanyl-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-(isopropoxycarbonylamino)-3-isopropylsulfanyl-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-3-methyl-1-oxo-2-[[oxo(propan-2-yloxy)methyl]amino]-3-(propan-2-ylthio)butyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-3-methyl-2-(propan-2-yloxycarbonylamino)-3-propan-2-ylsulfanylbutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-(isopropoxycarbonylamino)-3-(isopropylthio)-3-methyl-butanoyl]proline Formula: C17H30N2O5S MolecularWeight: 374.4955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC(C(=O)N1CCCC1C(=O)O)C(C)(C)SC(C)C

Isomeric SMILES

CC(C)OC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)(C)SC(C)C

InChI

InChI=1S/C17H30N2O5S/c1-10(2)24-16(23)18-13(17(5,6)25-11(3)4)14(20)19-9-7-8-12(19)15(21)22/h10-13H,7-9H2,1-6H3,(H,18,23)(H,21,22)/t12-,13+/m0/s1