5-methoxy-1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)indole

Systemtic Name: 5-methoxy-1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)indole Openeye Name: 5-methoxy-3-(2-phenylethynyl)-1-(p-tolylsulfonyl)indole CAS Name: 5-methoxy-1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)indole IUPAC Name: 5-methoxy-1-(4-methylphenyl)sulfonyl-3-(2-phenylethynyl)indole Traditional Name: 5-methoxy-3-(2-phenylethynyl)-1-tosyl-indole Formula: C24H19NO3S MolecularWeight: 401.47756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)OC)C#CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)OC)C#CC4=CC=CC=C4

InChI

InChI=1S/C24H19NO3S/c1-18-8-13-22(14-9-18)29(26,27)25-17-20(11-10-19-6-4-3-5-7-19)23-16-21(28-2)12-15-24(23)25/h3-9,12-17H,1-2H3