1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(2-phenyl-6-thiophen-2-yl-pyridin-4-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(2-phenyl-6-thiophen-2-yl-pyridin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-[[2-phenyl-6-(2-thienyl)-4-pyridyl]oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[3,3-dimethyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]-4-[(2-phenyl-6-thiophen-2-yl-4-pyridinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(2-phenyl-6-thiophen-2-ylpyridin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-[[2-phenyl-6-(2-thienyl)-4-pyridyl]oxy]proline Formula: C31H37N3O6S MolecularWeight: 579.70698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC(=C2)C3=CC=CS3)C4=CC=CC=C4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC(=C2)C3=CC=CS3)C4=CC=CC=C4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C31H37N3O6S/c1-30(2,3)26(33-29(38)40-31(4,5)6)27(35)34-18-21(17-24(34)28(36)37)39-20-15-22(19-11-8-7-9-12-19)32-23(16-20)25-13-10-14-41-25/h7-16,21,24,26H,17-18H2,1-6H3,(H,33,38)(H,36,37)