N-[(4-chlorophenyl)carbamothioyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[(4-chlorophenyl)carbamothioyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[(4-chlorophenyl)carbamothioyl]-5-nitro-furan-2-carboxamide CAS Name: N-[(4-chloroanilino)-sulfanylidenemethyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[(4-chlorophenyl)carbamothioyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[(4-chlorophenyl)thiocarbamoyl]-5-nitro-2-furamide Formula: C12H8ClN3O4S MolecularWeight: 325.72762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC=C(O2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)C2=CC=C(O2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H8ClN3O4S/c13-7-1-3-8(4-2-7)14-12(21)15-11(17)9-5-6-10(20-9)16(18)19/h1-6H,(H2,14,15,17,21)