N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide

Systemtic Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]-3-phenyl-propionamide Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C25H24ClN3O2S/c26-22-9-5-4-8-19(22)11-17-24(31)29-25(32)28-21-14-12-20(13-15-21)27-23(30)16-10-18-6-2-1-3-7-18/h1-9,12-15H,10-11,16-17H2,(H,27,30)(H2,28,29,31,32)