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

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-cyclopropylcarbonyl-5-(3-methylthiophen-2-yl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(cyclopropanecarbonyl)-5-(3-methyl-2-thienyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-[cyclopropyl(oxo)methyl]-5-(3-methyl-2-thiophenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(cyclopropanecarbonyl)-5-(3-methylthiophen-2-yl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(cyclopropanecarbonyl)-5-(3-methyl-2-thienyl)-3-(2-thienyl)proline Formula: C25H22ClNO4S2 MolecularWeight: 500.02948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CC3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CC3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H22ClNO4S2/c1-13-9-11-33-23(13)20-19(22(28)15-4-2-5-16(26)12-15)18(17-6-3-10-32-17)21(25(30)31)27(20)24(29)14-7-8-14/h2-6,9-12,14,18-21H,7-8H2,1H3,(H,30,31)