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

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2,4-difluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(2,4-difluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(2,4-difluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(2,4-difluorophenyl)sulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C20H19F2N3O3S2 MolecularWeight: 451.509966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C20H19F2N3O3S2/c1-12-3-2-4-16-18(12)23-20(29-16)24-19(26)13-7-9-25(10-8-13)30(27,28)17-6-5-14(21)11-15(17)22/h2-6,11,13H,7-10H2,1H3,(H,23,24,26)