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

Systemtic Name: 4-(3-chlorophenyl)carbonyl-5-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-5-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-4-[(3-chlorophenyl)-oxomethyl]-5-(3-methyl-2-thiophenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-5-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-5-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)-3-(2-thienyl)proline Formula: C28H23ClN2O4S2 MolecularWeight: 551.07622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)NC3=CC=CC=C3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)NC3=CC=CC=C3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H23ClN2O4S2/c1-16-12-14-37-26(16)23-22(25(32)17-7-5-8-18(29)15-17)21(20-11-6-13-36-20)24(27(33)34)31(23)28(35)30-19-9-3-2-4-10-19/h2-15,21-24H,1H3,(H,30,35)(H,33,34)