4-chloranyl-3-nitro-N-(oxolan-2-ylmethylcarbamothioyl)benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-(oxolan-2-ylmethylcarbamothioyl)benzamide Openeye Name: 4-chloro-3-nitro-N-(tetrahydrofuran-2-ylmethylcarbamothioyl)benzamide CAS Name: 4-chloro-3-nitro-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-(oxolan-2-ylmethylcarbamothioyl)benzamide Traditional Name: 4-chloro-3-nitro-N-(tetrahydrofurfurylthiocarbamoyl)benzamide Formula: C13H14ClN3O4S MolecularWeight: 343.78596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H14ClN3O4S/c14-10-4-3-8(6-11(10)17(19)20)12(18)16-13(22)15-7-9-2-1-5-21-9/h3-4,6,9H,1-2,5,7H2,(H2,15,16,18,22)