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

Systemtic Name: N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]-2-(4-methoxyphenyl)acetamide Formula: C18H18BrN3O4S MolecularWeight: 452.32222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3O4S/c1-25-13-6-3-11(4-7-13)9-16(23)20-18(27)22-21-17(24)12-5-8-15(26-2)14(19)10-12/h3-8,10H,9H2,1-2H3,(H,21,24)(H2,20,22,23,27)