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

Systemtic Name: 3-chloranyl-N-[4-[2-(4-propan-2-ylphenoxy)ethanoylcarbamothioylamino]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[[2-(4-isopropylphenoxy)acetyl]carbamothioylamino]phenyl]benzamide CAS Name: 3-chloro-N-[4-[[[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[[2-(4-propan-2-ylphenoxy)acetyl]carbamothioylamino]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[[2-(4-isopropylphenoxy)acetyl]thiocarbamoylamino]phenyl]benzamide Formula: C25H24ClN3O3S MolecularWeight: 481.99436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24ClN3O3S/c1-16(2)17-6-12-22(13-7-17)32-15-23(30)29-25(33)28-21-10-8-20(9-11-21)27-24(31)18-4-3-5-19(26)14-18/h3-14,16H,15H2,1-2H3,(H,27,31)(H2,28,29,30,33)