4-[(5Z)-5-(1,3-benzodioxol-4-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)butanamide

Systemtic Name: 4-[(5Z)-5-(1,3-benzodioxol-4-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)butanamide Openeye Name: 4-[(5Z)-5-(1,3-benzodioxol-4-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(o-tolyl)butanamide CAS Name: 4-[(5Z)-5-(1,3-benzodioxol-4-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-N-(2-methylphenyl)butanamide IUPAC Name: 4-[(5Z)-5-(1,3-benzodioxol-4-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-methylphenyl)butanamide Traditional Name: 4-[(5Z)-5-(1,3-benzodioxol-4-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]-N-(o-tolyl)butyramide Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCCN2C(=O)C(=CC3=C4C(=CC=C3)OCO4)SC2=S

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCCN2C(=O)/C(=C/C3=C4C(=CC=C3)OCO4)/SC2=S

InChI

InChI=1S/C22H20N2O4S2/c1-14-6-2-3-8-16(14)23-19(25)10-5-11-24-21(26)18(30-22(24)29)12-15-7-4-9-17-20(15)28-13-27-17/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,23,25)/b18-12-