3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)benzenecarbonitrile

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)benzenecarbonitrile Openeye Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)benzonitrile CAS Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)benzonitrile IUPAC Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)benzonitrile Traditional Name: 3-(4-chlorophenyl)sulfonyl-2-(5-mesylpentyl)benzonitrile Formula: C19H20ClNO4S2 MolecularWeight: 425.9494

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCCCC1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CS(=O)(=O)CCCCCC1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C19H20ClNO4S2/c1-26(22,23)13-4-2-3-7-18-15(14-21)6-5-8-19(18)27(24,25)17-11-9-16(20)10-12-17/h5-6,8-12H,2-4,7,13H2,1H3