N-(diethylcarbamothioyl)-3-nitro-benzamide

Systemtic Name: N-(diethylcarbamothioyl)-3-nitro-benzamide Openeye Name: N-(diethylcarbamothioyl)-3-nitro-benzamide CAS Name: N-[diethylamino(sulfanylidene)methyl]-3-nitrobenzamide IUPAC Name: N-(diethylcarbamothioyl)-3-nitrobenzamide Traditional Name: N-(diethylthiocarbamoyl)-3-nitro-benzamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O3S/c1-3-14(4-2)12(19)13-11(16)9-6-5-7-10(8-9)15(17)18/h5-8H,3-4H2,1-2H3,(H,13,16,19)