3-[azanyl-[7-(1,3-benzothiazol-2-yloxy)-4-methyl-2-oxidanylidene-6,7-dihydrochromen-3-yl]methyl]-2-fluoranyl-N-methyl-benzenesulfonamide

Systemtic Name: 3-[azanyl-[7-(1,3-benzothiazol-2-yloxy)-4-methyl-2-oxidanylidene-6,7-dihydrochromen-3-yl]methyl]-2-fluoranyl-N-methyl-benzenesulfonamide Openeye Name: 3-[amino-[7-(1,3-benzothiazol-2-yloxy)-4-methyl-2-oxo-6,7-dihydrochromen-3-yl]methyl]-2-fluoro-N-methyl-benzenesulfonamide CAS Name: 3-[amino-[7-(1,3-benzothiazol-2-yloxy)-4-methyl-2-oxo-6,7-dihydro-1-benzopyran-3-yl]methyl]-2-fluoro-N-methylbenzenesulfonamide IUPAC Name: 3-[amino-[7-(1,3-benzothiazol-2-yloxy)-4-methyl-2-oxo-6,7-dihydrochromen-3-yl]methyl]-2-fluoro-N-methylbenzenesulfonamide Traditional Name: 3-[amino-[7-(1,3-benzothiazol-2-yloxy)-2-keto-4-methyl-6,7-dihydrochromen-3-yl]methyl]-2-fluoro-N-methyl-benzenesulfonamide Formula: C25H22FN3O5S2 MolecularWeight: 527.587683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(CC=C12)OC3=NC4=CC=CC=C4S3)C(C5=C(C(=CC=C5)S(=O)(=O)NC)F)N

Isomeric SMILES

CC1=C(C(=O)OC2=CC(CC=C12)OC3=NC4=CC=CC=C4S3)C(C5=C(C(=CC=C5)S(=O)(=O)NC)F)N

InChI

InChI=1S/C25H22FN3O5S2/c1-13-15-11-10-14(33-25-29-17-7-3-4-8-19(17)35-25)12-18(15)34-24(30)21(13)23(27)16-6-5-9-20(22(16)26)36(31,32)28-2/h3-9,11-12,14,23,28H,10,27H2,1-2H3