3,5-bis(chloranyl)-N-[3-cyano-4-(4-methylphenyl)sulfonyl-phenyl]benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[3-cyano-4-(4-methylphenyl)sulfonyl-phenyl]benzamide Openeye Name: 3,5-dichloro-N-[3-cyano-4-(p-tolylsulfonyl)phenyl]benzamide CAS Name: 3,5-dichloro-N-[3-cyano-4-(4-methylphenyl)sulfonylphenyl]benzamide IUPAC Name: 3,5-dichloro-N-[3-cyano-4-(4-methylphenyl)sulfonylphenyl]benzamide Traditional Name: 3,5-dichloro-N-(3-cyano-4-tosyl-phenyl)benzamide Formula: C21H14Cl2N2O3S MolecularWeight: 445.31846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3)Cl)Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3)Cl)Cl)C#N

InChI

InChI=1S/C21H14Cl2N2O3S/c1-13-2-5-19(6-3-13)29(27,28)20-7-4-18(10-15(20)12-24)25-21(26)14-8-16(22)11-17(23)9-14/h2-11H,1H3,(H,25,26)