1-(4-fluorophenyl)-3-[4-methyl-2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[4-methyl-2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]urea Openeye Name: 1-[2-(benzenesulfonamido)-4-methyl-1,3-benzothiazol-6-yl]-3-(4-fluorophenyl)urea CAS Name: 1-[2-(benzenesulfonamido)-4-methyl-1,3-benzothiazol-6-yl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[2-(benzenesulfonamido)-4-methyl-1,3-benzothiazol-6-yl]-3-(4-fluorophenyl)urea Traditional Name: 1-[2-(benzenesulfonamido)-4-methyl-1,3-benzothiazol-6-yl]-3-(4-fluorophenyl)urea Formula: C21H17FN4O3S2 MolecularWeight: 456.513083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NS(=O)(=O)C3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NS(=O)(=O)C3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4O3S2/c1-13-11-16(24-20(27)23-15-9-7-14(22)8-10-15)12-18-19(13)25-21(30-18)26-31(28,29)17-5-3-2-4-6-17/h2-12H,1H3,(H,25,26)(H2,23,24,27)