6-[(5Z)-5-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[(5Z)-5-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[(5Z)-5-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[(5Z)-5-[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[(5Z)-5-[(1-butyl-5-chloro-3-methylpyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[(5Z)-5-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C18H24ClN3O3S2 MolecularWeight: 429.98446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C\2/C(=O)N(C(=S)S2)CCCCCC(=O)O)Cl

InChI

InChI=1S/C18H24ClN3O3S2/c1-3-4-10-22-16(19)13(12(2)20-22)11-14-17(25)21(18(26)27-14)9-7-5-6-8-15(23)24/h11H,3-10H2,1-2H3,(H,23,24)/b14-11-