11-[(5Z)-5-[(4-methylpiperazin-4-ium-1-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoate

Systemtic Name: 11-[(5Z)-5-[(4-methylpiperazin-4-ium-1-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoate Openeye Name: 11-[(5Z)-5-[(4-methylpiperazin-4-ium-1-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]undecanoate CAS Name: 11-[(5Z)-5-[(4-methyl-1-piperazin-4-iumyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]undecanoate IUPAC Name: 11-[(5Z)-5-[(4-methylpiperazin-4-ium-1-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoate Traditional Name: 11-[(5Z)-4-keto-5-[(4-methylpiperazin-4-ium-1-yl)methylene]-2-thioxo-thiazolidin-3-yl]undecanoate Formula: C20H33N3O3S2 MolecularWeight: 427.62432

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C=C2C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)/C=C\2/C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)[O-]

InChI

InChI=1S/C20H33N3O3S2/c1-21-12-14-22(15-13-21)16-17-19(26)23(20(27)28-17)11-9-7-5-3-2-4-6-8-10-18(24)25/h16H,2-15H2,1H3,(H,24,25)/b17-16-