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

Systemtic Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-ethylphenyl)butanamide Openeye Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(2-ethylphenyl)butanamide CAS Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-N-(2-ethylphenyl)butanamide IUPAC Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-ethylphenyl)butanamide Traditional Name: N-(2-ethylphenyl)-4-[(5Z)-4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl]butyramide Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CCCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CCCN2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=S

InChI

InChI=1S/C23H22N2O4S2/c1-2-16-6-3-4-7-17(16)24-21(26)8-5-11-25-22(27)20(31-23(25)30)13-15-9-10-18-19(12-15)29-14-28-18/h3-4,6-7,9-10,12-13H,2,5,8,11,14H2,1H3,(H,24,26)/b20-13-