(2R,3S,5R)-5-(imidazol-1-ylmethyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1-phenylmethoxycarbonyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate

Systemtic Name: (2R,3S,5R)-5-(imidazol-1-ylmethyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1-phenylmethoxycarbonyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate Openeye Name: (2R,3S,5R)-1-benzyloxycarbonyl-5-tert-butoxycarbonyl-5-(imidazol-1-ylmethyl)-2-(2-thienyl)pyrrolidine-3-carboxylate CAS Name: (2R,3S,5R)-5-(1-imidazolylmethyl)-5-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-phenylmethoxycarbonyl-2-thiophen-2-yl-3-pyrrolidinecarboxylate IUPAC Name: (2R,3S,5R)-5-(imidazol-1-ylmethyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-1-phenylmethoxycarbonyl-2-thiophen-2-ylpyrrolidine-3-carboxylate Traditional Name: (2R,3S,5R)-5-tert-butoxycarbonyl-1-carbobenzoxy-5-(imidazol-1-ylmethyl)-2-(2-thienyl)pyrrolidine-3-carboxylate Formula: C26H28N3O6S- MolecularWeight: 510.58202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CC(C(N1C(=O)OCC2=CC=CC=C2)C3=CC=CS3)C(=O)[O-])CN4C=CN=C4

Isomeric SMILES

CC(C)(C)OC(=O)[C@@]1(C[C@@H]([C@@H](N1C(=O)OCC2=CC=CC=C2)C3=CC=CS3)C(=O)[O-])CN4C=CN=C4

InChI

InChI=1S/C26H29N3O6S/c1-25(2,3)35-23(32)26(16-28-12-11-27-17-28)14-19(22(30)31)21(20-10-7-13-36-20)29(26)24(33)34-15-18-8-5-4-6-9-18/h4-13,17,19,21H,14-16H2,1-3H3,(H,30,31)/p-1/t19-,21+,26+/m0/s1