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

Systemtic Name: N-[3-ethyl-4,6-bis(fluoranyl)-1,3-benzothiazol-2-ylidene]-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-(3-methylpiperidino)sulfonyl-benzamide Formula: C22H23F2N3O3S2 MolecularWeight: 479.563126

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC(C4)C)F)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC(C4)C)F)F

InChI

InChI=1S/C22H23F2N3O3S2/c1-3-27-20-18(24)11-16(23)12-19(20)31-22(27)25-21(28)15-6-8-17(9-7-15)32(29,30)26-10-4-5-14(2)13-26/h6-9,11-12,14H,3-5,10,13H2,1-2H3