N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]-2-phenyl-acetamide Formula: C17H16BrN3O2S MolecularWeight: 406.29684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)CC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)CC2=CC=CC=C2)Br

InChI

InChI=1S/C17H16BrN3O2S/c1-11-7-8-13(10-14(11)18)16(23)20-21-17(24)19-15(22)9-12-5-3-2-4-6-12/h2-8,10H,9H2,1H3,(H,20,23)(H2,19,21,22,24)