N-(aminocarbonylcarbamothioyl)-3-nitro-benzamide

Systemtic Name: N-(aminocarbonylcarbamothioyl)-3-nitro-benzamide Openeye Name: N-(carbamoylcarbamothioyl)-3-nitro-benzamide CAS Name: N-[(carbamoylamino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-(carbamoylcarbamothioyl)-3-nitrobenzamide Traditional Name: N-(carbamoylthiocarbamoyl)-3-nitro-benzamide Formula: C9H8N4O4S MolecularWeight: 268.24922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N4O4S/c10-8(15)12-9(18)11-7(14)5-2-1-3-6(4-5)13(16)17/h1-4H,(H4,10,11,12,14,15,18)