5-(1,3-benzodioxol-5-ylmethylidene)-3-[(dibutylamino)methyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylidene)-3-[(dibutylamino)methyl]-1,3-thiazolidine-2,4-dione Openeye Name: 5-(1,3-benzodioxol-5-ylmethylene)-3-[(dibutylamino)methyl]thiazolidine-2,4-dione CAS Name: 5-(1,3-benzodioxol-5-ylmethylidene)-3-[(dibutylamino)methyl]thiazolidine-2,4-dione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylidene)-3-[(dibutylamino)methyl]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[(dibutylamino)methyl]-5-piperonylidene-thiazolidine-2,4-quinone Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)SC1=O

Isomeric SMILES

CCCCN(CCCC)CN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)SC1=O

InChI

InChI=1S/C20H26N2O4S/c1-3-5-9-21(10-6-4-2)13-22-19(23)18(27-20(22)24)12-15-7-8-16-17(11-15)26-14-25-16/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3