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

Systemtic Name: (5E)-5-[[3-(4-ethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-hexyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-[[3-(4-ethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-hexyl-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-[[3-(4-ethoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-hexyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-[[3-(4-ethoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-hexyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-3-hexyl-5-[(1-phenyl-3-p-phenetyl-pyrazol-4-yl)methylene]-2-thioxo-thiazolidin-4-one Formula: C27H29N3O2S2 MolecularWeight: 491.66806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O2S2/c1-3-5-6-10-17-29-26(31)24(34-27(29)33)18-21-19-30(22-11-8-7-9-12-22)28-25(21)20-13-15-23(16-14-20)32-4-2/h7-9,11-16,18-19H,3-6,10,17H2,1-2H3/b24-18+