1-(4-methylphenyl)sulfonyl-3-(pyridin-3-ylmethyl)-3-thiophen-2-yl-2H-indole

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-(pyridin-3-ylmethyl)-3-thiophen-2-yl-2H-indole Openeye Name: 1-(p-tolylsulfonyl)-3-(3-pyridylmethyl)-3-(2-thienyl)indoline CAS Name: 1-(4-methylphenyl)sulfonyl-3-(3-pyridinylmethyl)-3-thiophen-2-yl-2H-indole IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(pyridin-3-ylmethyl)-3-thiophen-2-yl-2H-indole Traditional Name: 3-(3-pyridylmethyl)-3-(2-thienyl)-1-tosyl-indoline Formula: C25H22N2O2S2 MolecularWeight: 446.58438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C3=CC=CC=C32)(CC4=CN=CC=C4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C3=CC=CC=C32)(CC4=CN=CC=C4)C5=CC=CS5

InChI

InChI=1S/C25H22N2O2S2/c1-19-10-12-21(13-11-19)31(28,29)27-18-25(24-9-5-15-30-24,16-20-6-4-14-26-17-20)22-7-2-3-8-23(22)27/h2-15,17H,16,18H2,1H3