5-bromanyl-N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-2-ethoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-2-ethoxy-benzamide Openeye Name: 5-bromo-N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-2-ethoxy-benzamide CAS Name: 5-bromo-N-[[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-ethoxybenzamide IUPAC Name: 5-bromo-N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-2-ethoxybenzamide Traditional Name: 5-bromo-2-ethoxy-N-[(veratroylamino)thiocarbamoyl]benzamide Formula: C19H20BrN3O5S MolecularWeight: 482.3482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H20BrN3O5S/c1-4-28-14-8-6-12(20)10-13(14)18(25)21-19(29)23-22-17(24)11-5-7-15(26-2)16(9-11)27-3/h5-10H,4H2,1-3H3,(H,22,24)(H2,21,23,25,29)