methyl 5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxy-3-nitro-phenyl)-4-phenyl-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxy-3-nitro-phenyl)-4-phenyl-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxy-3-nitro-phenyl)-4-phenyl-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxylate CAS Name: 5-[[(4-fluorophenyl)methylamino]-oxomethyl]-2-(4-methoxy-3-nitrophenyl)-1-[oxo(thiophen-2-yl)methyl]-4-phenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-fluorophenyl)methylcarbamoyl]-2-(4-methoxy-3-nitrophenyl)-4-phenyl-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 5-[(4-fluorobenzyl)carbamoyl]-2-(4-methoxy-3-nitro-phenyl)-4-phenyl-1-(2-thenoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C32H28FN3O7S MolecularWeight: 617.644023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C(C(N2C(=O)C3=CC=CS3)C(=O)NCC4=CC=C(C=C4)F)C5=CC=CC=C5)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(C(C(N2C(=O)C3=CC=CS3)C(=O)NCC4=CC=C(C=C4)F)C5=CC=CC=C5)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C32H28FN3O7S/c1-42-24-15-12-21(17-23(24)36(40)41)28-27(32(39)43-2)26(20-7-4-3-5-8-20)29(35(28)31(38)25-9-6-16-44-25)30(37)34-18-19-10-13-22(33)14-11-19/h3-17,26-29H,18H2,1-2H3,(H,34,37)