2-methylpropyl 3-(1,3-benzodioxol-5-ylcarbonyl)-2-phenyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl 3-(1,3-benzodioxol-5-ylcarbonyl)-2-phenyl-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(1,3-benzodioxole-5-carbonyl)-2-phenyl-thiazolidine-4-carboxylate CAS Name: 3-[1,3-benzodioxol-5-yl(oxo)methyl]-2-phenyl-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(1,3-benzodioxole-5-carbonyl)-2-phenyl-1,3-thiazolidine-4-carboxylate Traditional Name: 2-phenyl-3-piperonyloyl-thiazolidine-4-carboxylic acid isobutyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1CSC(N1C(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC(=O)C1CSC(N1C(=O)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C22H23NO5S/c1-14(2)11-26-22(25)17-12-29-21(15-6-4-3-5-7-15)23(17)20(24)16-8-9-18-19(10-16)28-13-27-18/h3-10,14,17,21H,11-13H2,1-2H3