N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)butanamide CAS Name: 4-(benzenesulfonyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)butanamide Traditional Name: 4-besyl-N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furfuryl)butyramide Formula: C22H19FN2O4S2 MolecularWeight: 458.525663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C22H19FN2O4S2/c23-16-10-11-19-20(14-16)30-22(24-19)25(15-17-6-4-12-29-17)21(26)9-5-13-31(27,28)18-7-2-1-3-8-18/h1-4,6-8,10-12,14H,5,9,13,15H2