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

Systemtic Name: 3-chloranyl-N-[4-[2-(4-nitrophenoxy)ethanoylcarbamothioylamino]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[[2-(4-nitrophenoxy)acetyl]carbamothioylamino]phenyl]benzamide CAS Name: 3-chloro-N-[4-[[[[2-(4-nitrophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[[2-(4-nitrophenoxy)acetyl]carbamothioylamino]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[[2-(4-nitrophenoxy)acetyl]thiocarbamoylamino]phenyl]benzamide Formula: C22H17ClN4O5S MolecularWeight: 484.91218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17ClN4O5S/c23-15-3-1-2-14(12-15)21(29)24-16-4-6-17(7-5-16)25-22(33)26-20(28)13-32-19-10-8-18(9-11-19)27(30)31/h1-12H,13H2,(H,24,29)(H2,25,26,28,33)