N-[3,5-bis-(4-methylphenyl)sulfonyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]benzenesulfonamide

Systemtic Name: N-[3,5-bis-(4-methylphenyl)sulfonyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]benzenesulfonamide Openeye Name: N-[4-oxo-3,5-bis(p-tolylsulfonyl)cyclohexa-2,5-dien-1-ylidene]benzenesulfonamide CAS Name: N-[3,5-bis-(4-methylphenyl)sulfonyl-4-oxo-1-cyclohexa-2,5-dienylidene]benzenesulfonamide IUPAC Name: N-[3,5-bis-(4-methylphenyl)sulfonyl-4-oxocyclohexa-2,5-dien-1-ylidene]benzenesulfonamide Traditional Name: N-(4-keto-3,5-ditosyl-cyclohexa-2,5-dien-1-ylidene)benzenesulfonamide Formula: C26H21NO7S3 MolecularWeight: 555.64244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=NS(=O)(=O)C3=CC=CC=C3)C=C(C2=O)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=NS(=O)(=O)C3=CC=CC=C3)C=C(C2=O)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H21NO7S3/c1-18-8-12-21(13-9-18)35(29,30)24-16-20(27-37(33,34)23-6-4-3-5-7-23)17-25(26(24)28)36(31,32)22-14-10-19(2)11-15-22/h3-17H,1-2H3