2-(4,5-dicyano-2-nitro-phenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide

Systemtic Name: 2-(4,5-dicyano-2-nitro-phenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide Openeye Name: 2-(4,5-dicyano-2-nitro-phenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide CAS Name: 2-[(4,5-dicyano-2-nitrophenyl)thio]-N-(3,4-dimethylphenyl)benzamide IUPAC Name: 2-(4,5-dicyano-2-nitrophenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide Traditional Name: 2-[(4,5-dicyano-2-nitro-phenyl)thio]-N-(3,4-dimethylphenyl)benzamide Formula: C23H16N4O3S MolecularWeight: 428.46314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-])C

InChI

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