N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]-3-methoxy-4-methyl-benzamide

Systemtic Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]-3-methoxy-4-methyl-benzamide Openeye Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]ethyl]-3-methoxy-4-methyl-benzamide CAS Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethyl]-3-methoxy-4-methylbenzamide IUPAC Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]-3-methoxy-4-methylbenzamide Traditional Name: N-[2-[(5E)-4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl]ethyl]-3-methoxy-4-methyl-benzamide Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCN2C(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/SC2=S)OC

InChI

InChI=1S/C22H20N2O5S2/c1-13-3-5-15(11-17(13)27-2)20(25)23-7-8-24-21(26)19(31-22(24)30)10-14-4-6-16-18(9-14)29-12-28-16/h3-6,9-11H,7-8,12H2,1-2H3,(H,23,25)/b19-10+