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

Systemtic Name: N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]-2-phenoxy-acetamide Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=CC=CC=C2)Br

InChI

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