N-[2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]-3-cyclohexyl-propanamide

Systemtic Name: N-[2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]-3-cyclohexyl-propanamide Openeye Name: N-[2-[5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]ethyl]-3-cyclohexyl-propanamide CAS Name: N-[2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethyl]-3-cyclohexylpropanamide IUPAC Name: N-[2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]-3-cyclohexylpropanamide Traditional Name: 3-cyclohexyl-N-[2-(4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl)ethyl]propionamide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NCCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S

Isomeric SMILES

C1CCC(CC1)CCC(=O)NCCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S

InChI

InChI=1S/C22H26N2O4S2/c25-20(9-7-15-4-2-1-3-5-15)23-10-11-24-21(26)19(30-22(24)29)13-16-6-8-17-18(12-16)28-14-27-17/h6,8,12-13,15H,1-5,7,9-11,14H2,(H,23,25)