ethyl 2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: ethyl 2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-(3,4-dichlorophenyl)-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-1-[oxo(thiophen-2-yl)methyl]-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dichlorophenyl)-5-[(4-fluorophenyl)methylcarbamoyl]-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(3,4-dichlorophenyl)-5-[(4-fluorobenzyl)carbamoyl]-1-(2-thenoyl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C26H23Cl2FN2O4S MolecularWeight: 549.441223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=CC=CS3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=CC=CS3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C26H23Cl2FN2O4S/c1-2-35-26(34)18-13-21(24(32)30-14-15-5-8-17(29)9-6-15)31(25(33)22-4-3-11-36-22)23(18)16-7-10-19(27)20(28)12-16/h3-12,18,21,23H,2,13-14H2,1H3,(H,30,32)