5-bromanyl-N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(veratroylamino)thiocarbamoyl]-2-furamide Formula: C15H14BrN3O5S MolecularWeight: 428.25776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br)OC

InChI

InChI=1S/C15H14BrN3O5S/c1-22-9-4-3-8(7-11(9)23-2)13(20)18-19-15(25)17-14(21)10-5-6-12(16)24-10/h3-7H,1-2H3,(H,18,20)(H2,17,19,21,25)