4-fluoranyl-N-[4-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[4-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[4-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-[4-[oxo-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[4-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[4-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Formula: C27H27FN4O3S2 MolecularWeight: 538.656683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H27FN4O3S2/c1-18(2)23-4-3-5-24-25(23)29-27(36-24)32-16-14-31(15-17-32)26(33)19-6-10-21(11-7-19)30-37(34,35)22-12-8-20(28)9-13-22/h3-13,18,30H,14-17H2,1-2H3