(5E)-3-hexyl-5-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-3-hexyl-5-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-3-hexyl-5-[[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5E)-3-hexyl-5-[[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-3-hexyl-5-[[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-3-hexyl-5-[[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C26H27N3OS2 MolecularWeight: 461.64208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)C)C4=CC=CC=C4)SC1=S

Isomeric SMILES

CCCCCCN1C(=O)/C(=C\C2=CN(N=C2C3=CC=C(C=C3)C)C4=CC=CC=C4)/SC1=S

InChI

InChI=1S/C26H27N3OS2/c1-3-4-5-9-16-28-25(30)23(32-26(28)31)17-21-18-29(22-10-7-6-8-11-22)27-24(21)20-14-12-19(2)13-15-20/h6-8,10-15,17-18H,3-5,9,16H2,1-2H3/b23-17+