4-tert-butyl-N-[2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-tert-butyl-N-[2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-tert-butyl-N-[2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-tert-butyl-N-[2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C26H23FN2O2S2 MolecularWeight: 478.601423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H23FN2O2S2/c1-26(2,3)18-8-4-17(5-9-18)24(31)28-20-12-13-21-23(14-20)33-25(29-21)32-15-22(30)16-6-10-19(27)11-7-16/h4-14H,15H2,1-3H3,(H,28,31)