5-bromanyl-N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]-2-methoxy-benzamide Formula: C17H15Br2N3O3S MolecularWeight: 501.1923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15Br2N3O3S/c1-9-3-4-10(7-13(9)19)15(23)21-22-17(26)20-16(24)12-8-11(18)5-6-14(12)25-2/h3-8H,1-2H3,(H,21,23)(H2,20,22,24,26)