5-(2,3-dihydroindol-1-ylsulfonyl)-2-[(4-methoxyphenyl)methylsulfanyl]benzoate

Systemtic Name: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-[(4-methoxyphenyl)methylsulfanyl]benzoate Openeye Name: 5-indolin-1-ylsulfonyl-2-[(4-methoxyphenyl)methylsulfanyl]benzoate CAS Name: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-[(4-methoxyphenyl)methylthio]benzoate IUPAC Name: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-[(4-methoxyphenyl)methylsulfanyl]benzoate Traditional Name: 5-indolin-1-ylsulfonyl-2-(p-anisylthio)benzoate Formula: C23H20NO5S2- MolecularWeight: 454.5386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C23H21NO5S2/c1-29-18-8-6-16(7-9-18)15-30-22-11-10-19(14-20(22)23(25)26)31(27,28)24-13-12-17-4-2-3-5-21(17)24/h2-11,14H,12-13,15H2,1H3,(H,25,26)/p-1