4-methyl-N-[3-[1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-ynyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-[1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-ynyl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-[1-(p-tolylsulfonyl)indol-3-yl]prop-2-ynyl]benzenesulfonamide CAS Name: 4-methyl-N-[3-[1-(4-methylphenyl)sulfonyl-3-indolyl]prop-2-ynyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[3-[1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-ynyl]benzenesulfonamide Traditional Name: 4-methyl-N-[3-(1-tosylindol-3-yl)prop-2-ynyl]benzenesulfonamide Formula: C25H22N2O4S2 MolecularWeight: 478.58318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC#CC2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC#CC2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H22N2O4S2/c1-19-9-13-22(14-10-19)32(28,29)26-17-5-6-21-18-27(25-8-4-3-7-24(21)25)33(30,31)23-15-11-20(2)12-16-23/h3-4,7-16,18,26H,17H2,1-2H3