(5E)-5-[(6-methyl-1,3-benzodioxol-5-yl)methylidene]-3-(2-methylpropyl)-2-phenylimino-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-[(6-methyl-1,3-benzodioxol-5-yl)methylidene]-3-(2-methylpropyl)-2-phenylimino-1,3-thiazolidin-4-one Openeye Name: (5E)-3-isobutyl-5-[(6-methyl-1,3-benzodioxol-5-yl)methylene]-2-phenylimino-thiazolidin-4-one CAS Name: (5E)-5-[(6-methyl-1,3-benzodioxol-5-yl)methylidene]-3-(2-methylpropyl)-2-phenylimino-4-thiazolidinone IUPAC Name: (5E)-5-[(6-methyl-1,3-benzodioxol-5-yl)methylidene]-3-(2-methylpropyl)-2-phenylimino-1,3-thiazolidin-4-one Traditional Name: (5E)-3-isobutyl-5-[(6-methyl-1,3-benzodioxol-5-yl)methylene]-2-phenylimino-thiazolidin-4-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C=C3C(=O)N(C(=NC4=CC=CC=C4)S3)CC(C)C)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1/C=C/3\C(=O)N(C(=NC4=CC=CC=C4)S3)CC(C)C)OCO2

InChI

InChI=1S/C22H22N2O3S/c1-14(2)12-24-21(25)20(28-22(24)23-17-7-5-4-6-8-17)11-16-10-19-18(9-15(16)3)26-13-27-19/h4-11,14H,12-13H2,1-3H3/b20-11+,23-22?