N-[4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide

Systemtic Name: N-[4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[[2-(o-tolyl)acetyl]carbamothioylamino]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[[2-(2-methylphenyl)acetyl]carbamothioylamino]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[[2-(o-tolyl)acetyl]thiocarbamoylamino]phenyl]-3-phenyl-propionamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O2S/c1-18-7-5-6-10-20(18)17-24(30)28-25(31)27-22-14-12-21(13-15-22)26-23(29)16-11-19-8-3-2-4-9-19/h2-10,12-15H,11,16-17H2,1H3,(H,26,29)(H2,27,28,30,31)