3-nitro-N-(phenacylcarbamothioyl)benzamide

Systemtic Name: 3-nitro-N-(phenacylcarbamothioyl)benzamide Openeye Name: 3-nitro-N-(phenacylcarbamothioyl)benzamide CAS Name: 3-nitro-N-[(phenacylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-(phenacylcarbamothioyl)benzamide Traditional Name: 3-nitro-N-(phenacylthiocarbamoyl)benzamide Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CNC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CNC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-14(11-5-2-1-3-6-11)10-17-16(24)18-15(21)12-7-4-8-13(9-12)19(22)23/h1-9H,10H2,(H2,17,18,21,24)