N-[2-[but-2-ynyl-(4-methylphenyl)sulfonyl-amino]phenyl]-4-methyl-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: N-[2-[but-2-ynyl-(4-methylphenyl)sulfonyl-amino]phenyl]-4-methyl-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-N-[2-[but-2-ynyl(p-tolylsulfonyl)amino]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[but-2-ynyl-(4-methylphenyl)sulfonylamino]phenyl]-4-methyl-N-prop-2-enylbenzenesulfonamide IUPAC Name: N-[2-[but-2-ynyl-(4-methylphenyl)sulfonylamino]phenyl]-4-methyl-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-N-[2-[but-2-ynyl(tosyl)amino]phenyl]-4-methyl-benzenesulfonamide Formula: C27H28N2O4S2 MolecularWeight: 508.65222

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN(C1=CC=CC=C1N(CC=C)S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC#CCN(C1=CC=CC=C1N(CC=C)S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H28N2O4S2/c1-5-7-21-29(35(32,33)25-18-14-23(4)15-19-25)27-11-9-8-10-26(27)28(20-6-2)34(30,31)24-16-12-22(3)13-17-24/h6,8-19H,2,20-21H2,1,3-4H3