N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-tosyl-propionamide Formula: C22H19FN2O4S2 MolecularWeight: 458.525663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C22H19FN2O4S2/c1-15-4-7-18(8-5-15)31(27,28)12-10-21(26)25(14-17-3-2-11-29-17)22-24-19-9-6-16(23)13-20(19)30-22/h2-9,11,13H,10,12,14H2,1H3