(5E)-5-[[3-(4-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-[[3-(4-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-[[3-(4-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-[[3-[4-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolyl]methylidene]-3-(2-oxolanylmethyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-[[3-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]methylidene]-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-5-[[3-(4-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-(tetrahydrofurfuryl)-2-thioxo-thiazolidin-4-one Formula: C28H28N4O5S3 MolecularWeight: 596.74072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5)C6=CC=CC=C6)SC2=S

Isomeric SMILES

C1CC(OC1)CN2C(=O)/C(=C\C3=CN(N=C3C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5)C6=CC=CC=C6)/SC2=S

InChI

InChI=1S/C28H28N4O5S3/c33-27-25(39-28(38)31(27)19-23-7-4-14-37-23)17-21-18-32(22-5-2-1-3-6-22)29-26(21)20-8-10-24(11-9-20)40(34,35)30-12-15-36-16-13-30/h1-3,5-6,8-11,17-18,23H,4,7,12-16,19H2/b25-17+