3-fluoranyl-N-[4-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]butyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-N-[4-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]butyl]benzenesulfonamide Openeye Name: 3-fluoro-N-[4-[[5-(2-methylbenzoyl)thiazol-2-yl]amino]butyl]benzenesulfonamide CAS Name: 3-fluoro-N-[4-[[5-[(2-methylphenyl)-oxomethyl]-2-thiazolyl]amino]butyl]benzenesulfonamide IUPAC Name: 3-fluoro-N-[4-[[5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino]butyl]benzenesulfonamide Traditional Name: 3-fluoro-N-[4-[(5-o-toluoylthiazol-2-yl)amino]butyl]benzenesulfonamide Formula: C21H22FN3O3S2 MolecularWeight: 447.546083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NCCCCNS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NCCCCNS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C21H22FN3O3S2/c1-15-7-2-3-10-18(15)20(26)19-14-24-21(29-19)23-11-4-5-12-25-30(27,28)17-9-6-8-16(22)13-17/h2-3,6-10,13-14,25H,4-5,11-12H2,1H3,(H,23,24)