N-[[4-chloranyl-2-(phenylcarbonyl)phenyl]carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[[4-chloranyl-2-(phenylcarbonyl)phenyl]carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[(2-benzoyl-4-chloro-phenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[(2-benzoyl-4-chloroanilino)-sulfanylidenemethyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[(2-benzoyl-4-chlorophenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[(2-benzoyl-4-chloro-phenyl)thiocarbamoyl]-5-(3-nitrophenyl)-2-furamide Formula: C25H16ClN3O5S MolecularWeight: 505.92964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H16ClN3O5S/c26-17-9-10-20(19(14-17)23(30)15-5-2-1-3-6-15)27-25(35)28-24(31)22-12-11-21(34-22)16-7-4-8-18(13-16)29(32)33/h1-14H,(H2,27,28,31,35)