5-nitro-N-[(3-phenoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-nitro-N-[(3-phenoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: 5-nitro-N-[(3-phenoxyphenyl)carbamothioyl]benzofuran-2-carboxamide CAS Name: 5-nitro-N-[(3-phenoxyanilino)-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: 5-nitro-N-[(3-phenoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: 5-nitro-N-[(3-phenoxyphenyl)thiocarbamoyl]coumarilamide Formula: C22H15N3O5S MolecularWeight: 433.4366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC4=C(O3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC4=C(O3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O5S/c26-21(20-12-14-11-16(25(27)28)9-10-19(14)30-20)24-22(31)23-15-5-4-8-18(13-15)29-17-6-2-1-3-7-17/h1-13H,(H2,23,24,26,31)