N-[4-[(4-bromophenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-[(4-bromophenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-[(4-bromobenzoyl)carbamothioylamino]-2-methoxy-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[[(4-bromophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-[(4-bromobenzoyl)carbamothioylamino]-2-methoxyphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-[(4-bromobenzoyl)thiocarbamoylamino]-2-methoxy-phenyl]coumarilamide Formula: C24H18BrN3O4S MolecularWeight: 524.38642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Br)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Br)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C24H18BrN3O4S/c1-31-20-13-17(26-24(33)28-22(29)14-6-8-16(25)9-7-14)10-11-18(20)27-23(30)21-12-15-4-2-3-5-19(15)32-21/h2-13H,1H3,(H,27,30)(H2,26,28,29,33)