5-[(4-methylpiperazin-4-ium-1-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(4-methylpiperazin-4-ium-1-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-isobutyl-5-[(4-methylpiperazin-4-ium-1-yl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[(4-methyl-1-piperazin-4-iumyl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(4-methylpiperazin-4-ium-1-yl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-isobutyl-5-[(4-methylpiperazin-4-ium-1-yl)methylene]-2-thioxo-thiazolidin-4-one Formula: C13H22N3OS2+ MolecularWeight: 300.46328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CN2CC[NH+](CC2)C)SC1=S

Isomeric SMILES

CC(C)CN1C(=O)C(=CN2CC[NH+](CC2)C)SC1=S

InChI

InChI=1S/C13H21N3OS2/c1-10(2)8-16-12(17)11(19-13(16)18)9-15-6-4-14(3)5-7-15/h9-10H,4-8H2,1-3H3/p+1