N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C22H19F2N3O4S3 MolecularWeight: 523.595766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(C=C(C=C4S3)F)F)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(C(C1)C(=O)N(CC2=CC=CO2)C3=NC4=C(C=C(C=C4S3)F)F)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H19F2N3O4S3/c23-14-11-16(24)20-18(12-14)33-22(25-20)26(13-15-5-3-9-31-15)21(28)17-6-1-2-8-27(17)34(29,30)19-7-4-10-32-19/h3-5,7,9-12,17H,1-2,6,8,13H2