ethyl 4-[2-fluoranyl-5-[(3-fluoranyl-4-methyl-phenyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-fluoranyl-5-[(3-fluoranyl-4-methyl-phenyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-fluoro-5-[(3-fluoro-4-methyl-phenyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[2-fluoro-5-[(3-fluoro-4-methylanilino)-oxomethyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-fluoro-5-[(3-fluoro-4-methylphenyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[2-fluoro-5-[(3-fluoro-4-methyl-phenyl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C21H23F2N3O5S MolecularWeight: 467.486226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C)F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=C(C=C3)C)F)F

InChI

InChI=1S/C21H23F2N3O5S/c1-3-31-21(28)25-8-10-26(11-9-25)32(29,30)19-12-15(5-7-17(19)22)20(27)24-16-6-4-14(2)18(23)13-16/h4-7,12-13H,3,8-11H2,1-2H3,(H,24,27)