4-(3-chlorophenyl)carbonyl-1-cyclobutylcarbonyl-5-(3-methylthiophen-2-yl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-cyclobutylcarbonyl-5-(3-methylthiophen-2-yl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(cyclobutanecarbonyl)-5-(3-methyl-2-thienyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-[cyclobutyl(oxo)methyl]-5-(3-methyl-2-thiophenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(cyclobutanecarbonyl)-5-(3-methylthiophen-2-yl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(cyclobutanecarbonyl)-5-(3-methyl-2-thienyl)-3-(2-thienyl)proline Formula: C26H24ClNO4S2 MolecularWeight: 514.05606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CCC3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CCC3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H24ClNO4S2/c1-14-10-12-34-24(14)21-20(23(29)16-7-3-8-17(27)13-16)19(18-9-4-11-33-18)22(26(31)32)28(21)25(30)15-5-2-6-15/h3-4,7-13,15,19-22H,2,5-6H2,1H3,(H,31,32)