(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-(1,3-benzodioxol-5-ylmethylene)-3-(piperidin-1-ium-1-ylmethyl)-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(1-piperidin-1-iumylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(piperidin-1-ium-1-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-3-(piperidin-1-ium-1-ylmethyl)-5-piperonylidene-2-thioxo-thiazolidin-4-one Formula: C17H19N2O3S2+ MolecularWeight: 363.47436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S

Isomeric SMILES

C1CC[NH+](CC1)CN2C(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/SC2=S

InChI

InChI=1S/C17H18N2O3S2/c20-16-15(9-12-4-5-13-14(8-12)22-11-21-13)24-17(23)19(16)10-18-6-2-1-3-7-18/h4-5,8-9H,1-3,6-7,10-11H2/p+1/b15-9+