4-methyl-N-[4-[(4-methylphenyl)sulfonyl-phenyl-amino]buta-1,3-diynyl]-N-phenyl-benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-[(4-methylphenyl)sulfonyl-phenyl-amino]buta-1,3-diynyl]-N-phenyl-benzenesulfonamide Openeye Name: 4-methyl-N-phenyl-N-[4-[N-(p-tolylsulfonyl)anilino]buta-1,3-diynyl]benzenesulfonamide CAS Name: 4-methyl-N-[4-(N-(4-methylphenyl)sulfonylanilino)buta-1,3-diynyl]-N-phenylbenzenesulfonamide IUPAC Name: 4-methyl-N-[4-(N-(4-methylphenyl)sulfonylanilino)buta-1,3-diynyl]-N-phenylbenzenesulfonamide Traditional Name: 4-methyl-N-phenyl-N-[4-(N-tosylanilino)buta-1,3-diynyl]benzenesulfonamide Formula: C30H24N2O4S2 MolecularWeight: 540.65256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C#CC#CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C#CC#CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C30H24N2O4S2/c1-25-15-19-29(20-16-25)37(33,34)31(27-11-5-3-6-12-27)23-9-10-24-32(28-13-7-4-8-14-28)38(35,36)30-21-17-26(2)18-22-30/h3-8,11-22H,1-2H3