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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)N(CC2=CC=CC=N2)C3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C21H15F2N3OS2/c22-14-10-17(23)20-18(11-14)29-21(25-20)26(12-15-6-4-5-9-24-15)19(27)13-28-16-7-2-1-3-8-16/h1-11H,12-13H2