1-(ethylcarbamoyl)-4-(2-methylphenyl)carbonyl-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(ethylcarbamoyl)-4-(2-methylphenyl)carbonyl-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(ethylcarbamoyl)-4-(2-methylbenzoyl)-3,5-bis(3-methyl-2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(ethylcarbamoyl)-4-[(2-methylphenyl)-oxomethyl]-3,5-bis(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(ethylcarbamoyl)-4-(2-methylbenzoyl)-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(ethylcarbamoyl)-3,5-bis(3-methyl-2-thienyl)-4-o-toluoyl-proline Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(C(C(C1C(=O)O)C2=C(C=CS2)C)C(=O)C3=CC=CC=C3C)C4=C(C=CS4)C

Isomeric SMILES

CCNC(=O)N1C(C(C(C1C(=O)O)C2=C(C=CS2)C)C(=O)C3=CC=CC=C3C)C4=C(C=CS4)C

InChI

InChI=1S/C26H28N2O4S2/c1-5-27-26(32)28-20(24-16(4)11-13-34-24)18(22(29)17-9-7-6-8-14(17)2)19(21(28)25(30)31)23-15(3)10-12-33-23/h6-13,18-21H,5H2,1-4H3,(H,27,32)(H,30,31)