N-(furan-2-ylmethylcarbamothioyl)-2-nitro-benzamide

Systemtic Name: N-(furan-2-ylmethylcarbamothioyl)-2-nitro-benzamide Openeye Name: N-(2-furylmethylcarbamothioyl)-2-nitro-benzamide CAS Name: N-[(2-furanylmethylamino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-(furan-2-ylmethylcarbamothioyl)-2-nitrobenzamide Traditional Name: N-(2-furfurylthiocarbamoyl)-2-nitro-benzamide Formula: C13H11N3O4S MolecularWeight: 305.30914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NCC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NCC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O4S/c17-12(10-5-1-2-6-11(10)16(18)19)15-13(21)14-8-9-4-3-7-20-9/h1-7H,8H2,(H2,14,15,17,21)