N-(3-chloranyl-4-fluoranyl-phenyl)-2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[[2-(3-cyanoanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-[2-(3-cyanoanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]benzamide Formula: C22H15ClFN3O2S MolecularWeight: 439.889803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)F)Cl)SCC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)F)Cl)SCC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H15ClFN3O2S/c23-18-11-16(8-9-19(18)24)27-22(29)17-6-1-2-7-20(17)30-13-21(28)26-15-5-3-4-14(10-15)12-25/h1-11H,13H2,(H,26,28)(H,27,29)