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

Systemtic Name: 3-chloranyl-N-[4-[2-(3,4-dimethylphenoxy)ethanoylcarbamothioylamino]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[[2-(3,4-dimethylphenoxy)acetyl]carbamothioylamino]phenyl]benzamide CAS Name: 3-chloro-N-[4-[[[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[[2-(3,4-dimethylphenoxy)acetyl]carbamothioylamino]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[[2-(3,4-dimethylphenoxy)acetyl]thiocarbamoylamino]phenyl]benzamide Formula: C24H22ClN3O3S MolecularWeight: 467.96778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C24H22ClN3O3S/c1-15-6-11-21(12-16(15)2)31-14-22(29)28-24(32)27-20-9-7-19(8-10-20)26-23(30)17-4-3-5-18(25)13-17/h3-13H,14H2,1-2H3,(H,26,30)(H2,27,28,29,32)