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

Systemtic Name: N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C19H20BrN3O6S MolecularWeight: 498.3476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O6S/c1-26-13-6-5-10(7-12(13)20)18(25)22-23-19(30)21-17(24)11-8-14(27-2)16(29-4)15(9-11)28-3/h5-9H,1-4H3,(H,22,25)(H2,21,23,24,30)