N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-2-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-2-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-methylsulfanyl-N-(2-pyridylmethyl)benzamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-(methylthio)-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-methylsulfanyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-2-(methylthio)-N-(2-pyridylmethyl)benzamide Formula: C21H15F2N3OS2 MolecularWeight: 427.490106

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C21H15F2N3OS2/c1-28-17-8-3-2-7-15(17)20(27)26(12-14-6-4-5-9-24-14)21-25-19-16(23)10-13(22)11-18(19)29-21/h2-11H,12H2,1H3