N-[[(4-methylphenyl)carbonylamino]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[(4-methylphenyl)carbonylamino]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[(4-methylbenzoyl)amino]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[[(4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[(4-methylbenzoyl)amino]carbamothioyl]-3-phenylpropanamide Traditional Name: 3-phenyl-N-[(p-toluoylamino)thiocarbamoyl]propionamide Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C18H19N3O2S/c1-13-7-10-15(11-8-13)17(23)20-21-18(24)19-16(22)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H,20,23)(H2,19,21,22,24)