N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(3-fluoranyl-4-methyl-phenyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(3-fluoranyl-4-methyl-phenyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(3-fluoro-4-methyl-phenyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(3-fluoro-4-methylphenyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-ethylsulfonyl-N-(3-fluoro-4-methylphenyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-esyl-N-(3-fluoro-4-methyl-phenyl)isonipecotamide Formula: C22H24FN3O3S2 MolecularWeight: 461.572663

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)N(C2=CC(=C(C=C2)C)F)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)N(C2=CC(=C(C=C2)C)F)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24FN3O3S2/c1-3-31(28,29)25-12-10-16(11-13-25)21(27)26(17-9-8-15(2)18(23)14-17)22-24-19-6-4-5-7-20(19)30-22/h4-9,14,16H,3,10-13H2,1-2H3