5-nitro-N-[4-(4-nitrophenyl)sulfanylphenyl]-1-benzofuran-3-carboxamide

Systemtic Name: 5-nitro-N-[4-(4-nitrophenyl)sulfanylphenyl]-1-benzofuran-3-carboxamide Openeye Name: 5-nitro-N-[4-(4-nitrophenyl)sulfanylphenyl]benzofuran-3-carboxamide CAS Name: 5-nitro-N-[4-[(4-nitrophenyl)thio]phenyl]-3-benzofurancarboxamide IUPAC Name: 5-nitro-N-[4-(4-nitrophenyl)sulfanylphenyl]-1-benzofuran-3-carboxamide Traditional Name: 5-nitro-N-[4-[(4-nitrophenyl)thio]phenyl]benzofuran-3-carboxamide Formula: C21H13N3O6S MolecularWeight: 435.40942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=COC3=C2C=C(C=C3)[N+](=O)[O-])SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=COC3=C2C=C(C=C3)[N+](=O)[O-])SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13N3O6S/c25-21(19-12-30-20-10-5-15(24(28)29)11-18(19)20)22-13-1-6-16(7-2-13)31-17-8-3-14(4-9-17)23(26)27/h1-12H,(H,22,25)