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

Systemtic Name: N-[2-methoxy-4-[(4-nitrophenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methoxy-4-[(4-nitrobenzoyl)carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[2-methoxy-4-[[[[(4-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[2-methoxy-4-[(4-nitrobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[2-methoxy-4-[(4-nitrobenzoyl)thiocarbamoylamino]phenyl]coumarilamide Formula: C24H18N4O6S MolecularWeight: 490.48792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C24H18N4O6S/c1-33-20-13-16(25-24(35)27-22(29)14-6-9-17(10-7-14)28(31)32)8-11-18(20)26-23(30)21-12-15-4-2-3-5-19(15)34-21/h2-13H,1H3,(H,26,30)(H2,25,27,29,35)