3-(4-tert-butylphenyl)-1-cyclopropylcarbonyl-5-(4-fluorophenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-1-cyclopropylcarbonyl-5-(4-fluorophenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1-[cyclopropyl(oxo)methyl]-5-(4-fluorophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-4-(2-thenoyl)proline Formula: C30H30FNO4S MolecularWeight: 519.626903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)C3CC3)C4=CC=C(C=C4)F)C(=O)C5=CC=CS5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)C3CC3)C4=CC=C(C=C4)F)C(=O)C5=CC=CS5

InChI

InChI=1S/C30H30FNO4S/c1-30(2,3)20-12-8-17(9-13-20)23-24(27(33)22-5-4-16-37-22)25(18-10-14-21(31)15-11-18)32(26(23)29(35)36)28(34)19-6-7-19/h4-5,8-16,19,23-26H,6-7H2,1-3H3,(H,35,36)