(5E)-5-[[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-[[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-[[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-[(4-fluorophenyl)methyl]-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-[[3-(4-butoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-[[3-(4-butoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-[(4-fluorophenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-5-[[3-(4-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-(4-fluorobenzyl)-2-thioxo-thiazolidin-4-one Formula: C30H26FN3O2S2 MolecularWeight: 543.674743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C/3\C(=O)N(C(=S)S3)CC4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C30H26FN3O2S2/c1-2-3-17-36-26-15-11-22(12-16-26)28-23(20-34(32-28)25-7-5-4-6-8-25)18-27-29(35)33(30(37)38-27)19-21-9-13-24(31)14-10-21/h4-16,18,20H,2-3,17,19H2,1H3/b27-18+