N-[3-[[5-(3-nitrophenyl)furan-2-yl]carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[[5-(3-nitrophenyl)furan-2-yl]carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-[[5-(3-nitrophenyl)furan-2-carbonyl]carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[3-[[[[[5-(3-nitrophenyl)-2-furanyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-[[5-(3-nitrophenyl)furan-2-carbonyl]carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-[[5-(3-nitrophenyl)-2-furoyl]thiocarbamoylamino]phenyl]coumarilamide Formula: C27H18N4O6S MolecularWeight: 526.52002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H18N4O6S/c32-25(23-12-11-22(36-23)16-6-3-9-20(13-16)31(34)35)30-27(38)29-19-8-4-7-18(15-19)28-26(33)24-14-17-5-1-2-10-21(17)37-24/h1-15H,(H,28,33)(H2,29,30,32,38)