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

Systemtic Name: N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]-2-phenyl-acetamide Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)CC2=CC=CC=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)CC2=CC=CC=C2)Br

InChI

InChI=1S/C17H16BrN3O3S/c1-24-14-8-7-12(10-13(14)18)16(23)20-21-17(25)19-15(22)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,20,23)(H2,19,21,22,25)