N-(4-aminocarbonyl-3-chloranyl-phenyl)-1-[2,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-aminocarbonyl-3-chloranyl-phenyl)-1-[2,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-carbamoyl-3-chloro-phenyl)-1-(2,5-difluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-carbamoyl-3-chlorophenyl)-1-(2,5-difluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-carbamoyl-3-chlorophenyl)-1-(2,5-difluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-carbamoyl-3-chloro-phenyl)-1-(2,5-difluorophenyl)sulfonyl-isonipecotamide Formula: C19H18ClF2N3O4S MolecularWeight: 457.878726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)C(=O)N)Cl)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)C(=O)N)Cl)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C19H18ClF2N3O4S/c20-15-10-13(2-3-14(15)18(23)26)24-19(27)11-5-7-25(8-6-11)30(28,29)17-9-12(21)1-4-16(17)22/h1-4,9-11H,5-8H2,(H2,23,26)(H,24,27)