N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C20H19F2N3O4S2 MolecularWeight: 467.509366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C20H19F2N3O4S2/c1-29-14-4-6-15(7-5-14)31(27,28)25-8-2-3-12(11-25)19(26)24-20-23-18-16(22)9-13(21)10-17(18)30-20/h4-7,9-10,12H,2-3,8,11H2,1H3,(H,23,24,26)