(2S)-1-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-thiophen-3-yl-ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-thiophen-3-yl-ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-(tert-butoxycarbonylamino)-2-(3-thienyl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-2-(3-thiophenyl)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-thiophen-3-ylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-(tert-butoxycarbonylamino)-2-(3-thienyl)acetyl]proline Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CSC=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C1=CSC=C1)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C16H22N2O5S/c1-16(2,3)23-15(22)17-12(10-6-8-24-9-10)13(19)18-7-4-5-11(18)14(20)21/h6,8-9,11-12H,4-5,7H2,1-3H3,(H,17,22)(H,20,21)/t11-,12+/m0/s1