4-fluoranyl-N-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-fluoro-N-[2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-fluoro-N-[2-[[2-(4-methylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-fluoro-N-[2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-fluoro-N-[2-[[2-keto-2-(p-toluidino)ethyl]thio]-1,3-benzothiazol-6-yl]benzamide Formula: C23H18FN3O2S2 MolecularWeight: 451.536323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H18FN3O2S2/c1-14-2-8-17(9-3-14)25-21(28)13-30-23-27-19-11-10-18(12-20(19)31-23)26-22(29)15-4-6-16(24)7-5-15/h2-12H,13H2,1H3,(H,25,28)(H,26,29)