N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3,5-bis(chloranyl)benzamide

Systemtic Name: N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3,5-bis(chloranyl)benzamide Openeye Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]-3,5-dichloro-benzamide CAS Name: N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3,5-dichlorobenzamide IUPAC Name: N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]-3,5-dichlorobenzamide Traditional Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]-3,5-dichloro-benzamide Formula: C16H12BrCl2N3O3S MolecularWeight: 477.15978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrCl2N3O3S/c1-25-13-3-2-8(6-12(13)17)15(24)21-22-16(26)20-14(23)9-4-10(18)7-11(19)5-9/h2-7H,1H3,(H,21,24)(H2,20,22,23,26)