2-[(5E)-5-[(E)-2-methyl-3-phenyl-prop-2-enylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide

Systemtic Name: 2-[(5E)-5-[(E)-2-methyl-3-phenyl-prop-2-enylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide Openeye Name: 2-[(5E)-5-[(E)-2-methyl-3-phenyl-prop-2-enylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide CAS Name: 2-[(5E)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-N-(4-methyl-1-piperazin-4-iumyl)acetamide IUPAC Name: 2-[(5E)-5-[(E)-2-methyl-3-phenylprop-2-enylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Traditional Name: 2-[(5E)-4-keto-5-[(E)-2-methyl-3-phenyl-prop-2-enylidene]-2-thioxo-thiazolidin-3-yl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C20H25N4O2S2+ MolecularWeight: 417.5681

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C=C/2\C(=O)N(C(=S)S2)CC(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C20H24N4O2S2/c1-15(12-16-6-4-3-5-7-16)13-17-19(26)24(20(27)28-17)14-18(25)21-23-10-8-22(2)9-11-23/h3-7,12-13H,8-11,14H2,1-2H3,(H,21,25)/p+1/b15-12+,17-13+