N-[6-(4,5-dihydro-[1]benzothiepino[5,4-d][1,3]thiazol-2-ylamino)hexyl]-2-fluoranyl-6-methyl-benzenesulfonamide

Systemtic Name: N-[6-(4,5-dihydro-[1]benzothiepino[5,4-d][1,3]thiazol-2-ylamino)hexyl]-2-fluoranyl-6-methyl-benzenesulfonamide Openeye Name: N-[6-(4,5-dihydro-[1]benzothiepino[5,4-d]thiazol-2-ylamino)hexyl]-2-fluoro-6-methyl-benzenesulfonamide CAS Name: N-[6-(4,5-dihydro-[1]benzothiepino[5,4-d]thiazol-2-ylamino)hexyl]-2-fluoro-6-methylbenzenesulfonamide IUPAC Name: N-[6-(4,5-dihydro-[1]benzothiepino[5,4-d][1,3]thiazol-2-ylamino)hexyl]-2-fluoro-6-methylbenzenesulfonamide Traditional Name: N-[6-(4,5-dihydro-[1]benzothiepino[5,4-d]thiazol-2-ylamino)hexyl]-2-fluoro-6-methyl-benzenesulfonamide Formula: C24H28FN3O2S3 MolecularWeight: 505.691423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)F)S(=O)(=O)NCCCCCCNC2=NC3=C(S2)CCSC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=CC=C1)F)S(=O)(=O)NCCCCCCNC2=NC3=C(S2)CCSC4=CC=CC=C43

InChI

InChI=1S/C24H28FN3O2S3/c1-17-9-8-11-19(25)23(17)33(29,30)27-15-7-3-2-6-14-26-24-28-22-18-10-4-5-12-20(18)31-16-13-21(22)32-24/h4-5,8-12,27H,2-3,6-7,13-16H2,1H3,(H,26,28)