N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(furan-2-ylmethyl)-3-phenyl-propanamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(furan-2-ylmethyl)-3-phenyl-propanamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-phenyl-propanamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-phenylpropanamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenylpropanamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-phenyl-propionamide Formula: C21H16F2N2O2S MolecularWeight: 398.425746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C21H16F2N2O2S/c22-15-11-17(23)20-18(12-15)28-21(24-20)25(13-16-7-4-10-27-16)19(26)9-8-14-5-2-1-3-6-14/h1-7,10-12H,8-9,13H2