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

Systemtic Name: 2-[(5Z)-5-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5Z)-5-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5Z)-5-[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5Z)-5-[(1-butyl-5-chloro-3-methylpyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5Z)-5-[(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C14H16ClN3O3S2 MolecularWeight: 373.87814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClN3O3S2/c1-3-4-5-18-12(15)9(8(2)16-18)6-10-13(21)17(7-11(19)20)14(22)23-10/h6H,3-5,7H2,1-2H3,(H,19,20)/b10-6-