6-[[3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-[[3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[[3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[[3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[[3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[[4-keto-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-thioxo-thiazolidin-5-ylidene]methyl]-2,3-dimethoxy-benzoic acid Formula: C24H21N3O6S2 MolecularWeight: 511.57004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=C(C(=C(C=C4)OC)OC)C(=O)O)SC3=S

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=C(C(=C(C=C4)OC)OC)C(=O)O)SC3=S

InChI

InChI=1S/C24H21N3O6S2/c1-13-19(22(29)27(25(13)2)15-8-6-5-7-9-15)26-21(28)17(35-24(26)34)12-14-10-11-16(32-3)20(33-4)18(14)23(30)31/h5-12H,1-4H3,(H,30,31)