2-(4,5-dicyano-2-nitro-phenyl)sulfanyl-N-(4-ethylphenyl)benzamide

Systemtic Name: 2-(4,5-dicyano-2-nitro-phenyl)sulfanyl-N-(4-ethylphenyl)benzamide Openeye Name: 2-(4,5-dicyano-2-nitro-phenyl)sulfanyl-N-(4-ethylphenyl)benzamide CAS Name: 2-[(4,5-dicyano-2-nitrophenyl)thio]-N-(4-ethylphenyl)benzamide IUPAC Name: 2-(4,5-dicyano-2-nitrophenyl)sulfanyl-N-(4-ethylphenyl)benzamide Traditional Name: 2-[(4,5-dicyano-2-nitro-phenyl)thio]-N-(4-ethylphenyl)benzamide Formula: C23H16N4O3S MolecularWeight: 428.46314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O3S/c1-2-15-7-9-18(10-8-15)26-23(28)19-5-3-4-6-21(19)31-22-12-17(14-25)16(13-24)11-20(22)27(29)30/h3-12H,2H2,1H3,(H,26,28)