N-[(3-nitrophenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(3-nitrophenyl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(3-nitrophenyl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[(3-nitroanilino)-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(3-nitrophenyl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(3-nitrophenyl)thiocarbamoyl]coumarilamide Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11N3O4S/c20-15(14-8-10-4-1-2-7-13(10)23-14)18-16(24)17-11-5-3-6-12(9-11)19(21)22/h1-9H,(H2,17,18,20,24)