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

Systemtic Name: 2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]thio]-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-[2-(3-cyanoanilino)-2-oxoethyl]sulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Formula: C23H15FN4O2S2 MolecularWeight: 462.519203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)F)SCC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)F)SCC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H15FN4O2S2/c24-15-8-9-18-20(11-15)32-23(27-18)28-22(30)17-6-1-2-7-19(17)31-13-21(29)26-16-5-3-4-14(10-16)12-25/h1-11H,13H2,(H,26,29)(H,27,28,30)