methyl 4-[[3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-2-oxidanylidene-imidazolidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-2-oxidanylidene-imidazolidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-(1-methylsulfonylindolin-5-yl)-2-oxo-imidazolidin-1-yl]methyl]benzoate CAS Name: 4-[[3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-2-oxo-1-imidazolidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1-methylsulfonyl-2,3-dihydroindol-5-yl)-2-oxoimidazolidin-1-yl]methyl]benzoate Traditional Name: 4-[[2-keto-3-(1-mesylindolin-5-yl)imidazolidin-1-yl]methyl]benzoic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCN(C2=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCN(C2=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H23N3O5S/c1-29-20(25)16-5-3-15(4-6-16)14-22-11-12-23(21(22)26)18-7-8-19-17(13-18)9-10-24(19)30(2,27)28/h3-8,13H,9-12,14H2,1-2H3