N-[(carbamothioylamino)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[(carbamothioylamino)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(carbamothioylamino)carbamothioyl]-3-nitro-benzamide CAS Name: N-[(carbamothioylhydrazo)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(carbamothioylamino)carbamothioyl]-3-nitrobenzamide Traditional Name: 3-nitro-N-(thioureidothiocarbamoyl)benzamide Formula: C9H9N5O3S2 MolecularWeight: 299.32946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9N5O3S2/c10-8(18)12-13-9(19)11-7(15)5-2-1-3-6(4-5)14(16)17/h1-4H,(H3,10,12,18)(H2,11,13,15,19)