N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-N-(pyridin-2-ylmethyl)propanamide Openeye Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-N-(2-pyridylmethyl)propanamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(phenylthio)-N-(2-pyridinylmethyl)propanamide IUPAC Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-N-(pyridin-2-ylmethyl)propanamide Traditional Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-(phenylthio)-N-(2-pyridylmethyl)propionamide Formula: C22H18FN3OS2 MolecularWeight: 423.526223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18FN3OS2/c23-18-10-6-11-19-21(18)25-22(29-19)26(15-16-7-4-5-13-24-16)20(27)12-14-28-17-8-2-1-3-9-17/h1-11,13H,12,14-15H2