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

Systemtic Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(3-morpholin-4-ylpropyl)butanamide Openeye Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(3-morpholinopropyl)butanamide CAS Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-N-[3-(4-morpholinyl)propyl]butanamide IUPAC Name: 4-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(3-morpholin-4-ylpropyl)butanamide Traditional Name: 4-[(5Z)-4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl]-N-(3-morpholinopropyl)butyramide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)CCCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S

Isomeric SMILES

C1COCCN1CCCNC(=O)CCCN2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=S

InChI

InChI=1S/C22H27N3O5S2/c26-20(23-6-2-7-24-9-11-28-12-10-24)3-1-8-25-21(27)19(32-22(25)31)14-16-4-5-17-18(13-16)30-15-29-17/h4-5,13-14H,1-3,6-12,15H2,(H,23,26)/b19-14-