N-(3-ethyl-6-fluoranyl-1,3-benzothiazol-2-ylidene)-4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(3-ethyl-6-fluoranyl-1,3-benzothiazol-2-ylidene)-4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-(3-ethyl-6-fluoro-1,3-benzothiazol-2-ylidene)-4-[[(2R)-2-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-(3-ethyl-6-fluoro-1,3-benzothiazol-2-ylidene)-4-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-(3-ethyl-6-fluoro-1,3-benzothiazol-2-ylidene)-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-(3-ethyl-6-fluoro-1,3-benzothiazol-2-ylidene)-4-[(2R)-2-methylpiperidino]sulfonyl-benzamide Formula: C22H24FN3O3S2 MolecularWeight: 461.572663

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC[C@H]4C

InChI

InChI=1S/C22H24FN3O3S2/c1-3-25-19-12-9-17(23)14-20(19)30-22(25)24-21(27)16-7-10-18(11-8-16)31(28,29)26-13-5-4-6-15(26)2/h7-12,14-15H,3-6,13H2,1-2H3/t15-/m1/s1