2-[2-[1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-indol-3-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-indol-3-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[1-(p-tolylsulfonyl)-5-(2-thienyl)indol-3-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-3-indolyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[1-(4-methylphenyl)sulfonyl-5-thiophen-2-ylindol-3-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[5-(2-thienyl)-1-tosyl-indol-3-yl]ethyl]isoindoline-1,3-quinone Formula: C29H22N2O4S2 MolecularWeight: 526.62598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C4=CC=CS4)CCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C4=CC=CS4)CCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C29H22N2O4S2/c1-19-8-11-22(12-9-19)37(34,35)31-18-21(25-17-20(10-13-26(25)31)27-7-4-16-36-27)14-15-30-28(32)23-5-2-3-6-24(23)29(30)33/h2-13,16-18H,14-15H2,1H3