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

Systemtic Name: (3R)-N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3R)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)nipecotamide Formula: C17H15F2N3O3S3 MolecularWeight: 443.511106

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C17H15F2N3O3S3/c18-11-7-12(19)15-13(8-11)27-17(20-15)21-16(23)10-3-1-5-22(9-10)28(24,25)14-4-2-6-26-14/h2,4,6-8,10H,1,3,5,9H2,(H,20,21,23)/t10-/m1/s1