2-(2-chloranylphenoxy)-N-[4-(2-phenylethanoylcarbamothioylamino)phenyl]propanamide

Systemtic Name: 2-(2-chloranylphenoxy)-N-[4-(2-phenylethanoylcarbamothioylamino)phenyl]propanamide Openeye Name: 2-(2-chlorophenoxy)-N-[4-[(2-phenylacetyl)carbamothioylamino]phenyl]propanamide CAS Name: 2-(2-chlorophenoxy)-N-[4-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: 2-(2-chlorophenoxy)-N-[4-[(2-phenylacetyl)carbamothioylamino]phenyl]propanamide Traditional Name: 2-(2-chlorophenoxy)-N-[4-[(2-phenylacetyl)thiocarbamoylamino]phenyl]propionamide Formula: C24H22ClN3O3S MolecularWeight: 467.96778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2)OC3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2)OC3=CC=CC=C3Cl

InChI

InChI=1S/C24H22ClN3O3S/c1-16(31-21-10-6-5-9-20(21)25)23(30)26-18-11-13-19(14-12-18)27-24(32)28-22(29)15-17-7-3-2-4-8-17/h2-14,16H,15H2,1H3,(H,26,30)(H2,27,28,29,32)