N-[2-methoxy-4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-methoxy-4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methoxy-4-[(4-methoxy-3-nitro-benzoyl)carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[2-methoxy-4-[[[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[2-methoxy-4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[2-methoxy-4-[(4-methoxy-3-nitro-benzoyl)thiocarbamoylamino]phenyl]coumarilamide Formula: C25H20N4O7S MolecularWeight: 520.5139

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O7S/c1-34-20-10-7-15(11-18(20)29(32)33)23(30)28-25(37)26-16-8-9-17(21(13-16)35-2)27-24(31)22-12-14-5-3-4-6-19(14)36-22/h3-13H,1-2H3,(H,27,31)(H2,26,28,30,37)