N-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]benzamide Formula: C23H19ClFN3O3S MolecularWeight: 471.931663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C23H19ClFN3O3S/c1-31-18-8-5-14(6-9-18)11-21(29)28-23(32)27-16-4-2-3-15(12-16)22(30)26-17-7-10-20(25)19(24)13-17/h2-10,12-13H,11H2,1H3,(H,26,30)(H2,27,28,29,32)