N-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-naphthalen-1-ylethanoylcarbamothioylamino)benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-naphthalen-1-ylethanoylcarbamothioylamino)benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-[[2-(1-naphthyl)acetyl]carbamothioylamino]benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[[[[2-(1-naphthalenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-[(2-naphthalen-1-ylacetyl)carbamothioylamino]benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-[[2-(1-naphthyl)acetyl]thiocarbamoylamino]benzamide Formula: C26H19ClFN3O2S MolecularWeight: 491.964363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NC(=S)NC3=CC=CC(=C3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NC(=S)NC3=CC=CC(=C3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C26H19ClFN3O2S/c27-22-15-20(11-12-23(22)28)29-25(33)18-8-4-9-19(13-18)30-26(34)31-24(32)14-17-7-3-6-16-5-1-2-10-21(16)17/h1-13,15H,14H2,(H,29,33)(H2,30,31,32,34)