1-[2-(cyclopentyloxycarbonylamino)-3,3-dimethyl-butanoyl]-4-(2-thiophen-3-ylpyridin-4-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(cyclopentyloxycarbonylamino)-3,3-dimethyl-butanoyl]-4-(2-thiophen-3-ylpyridin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(cyclopentoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-[[2-(3-thienyl)-4-pyridyl]oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[cyclopentyloxy(oxo)methyl]amino]-3,3-dimethyl-1-oxobutyl]-4-[[2-(3-thiophenyl)-4-pyridinyl]oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(cyclopentyloxycarbonylamino)-3,3-dimethylbutanoyl]-4-(2-thiophen-3-ylpyridin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(cyclopentoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-[[2-(3-thienyl)-4-pyridyl]oxy]proline Formula: C26H33N3O6S MolecularWeight: 515.62172

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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=CSC=C3)NC(=O)OC4CCCC4

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC=C2)C3=CSC=C3)NC(=O)OC4CCCC4

InChI

InChI=1S/C26H33N3O6S/c1-26(2,3)22(28-25(33)35-17-6-4-5-7-17)23(30)29-14-19(13-21(29)24(31)32)34-18-8-10-27-20(12-18)16-9-11-36-15-16/h8-12,15,17,19,21-22H,4-7,13-14H2,1-3H3,(H,28,33)(H,31,32)