(3E)-5-(3-methoxy-4-oxidanyl-phenyl)-N-(2-methoxyphenyl)-3-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)pyrazolidine-1-carbothioamide

Systemtic Name: (3E)-5-(3-methoxy-4-oxidanyl-phenyl)-N-(2-methoxyphenyl)-3-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)pyrazolidine-1-carbothioamide Openeye Name: (3E)-5-(4-hydroxy-3-methoxy-phenyl)-3-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-(2-methoxyphenyl)pyrazolidine-1-carbothioamide CAS Name: (3E)-5-(4-hydroxy-3-methoxyphenyl)-3-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-N-(2-methoxyphenyl)-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-5-(4-hydroxy-3-methoxyphenyl)-3-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-N-(2-methoxyphenyl)pyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-(4-hydroxy-3-methoxy-phenyl)-N-(2-methoxyphenyl)pyrazolidine-1-carbothioamide Formula: C24H23N3O5S MolecularWeight: 465.52152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)N2C(CC(=C3C=CC(=O)C=C3O)N2)C4=CC(=C(C=C4)O)OC

Isomeric SMILES

COC1=CC=CC=C1NC(=S)N2C(C/C(=C\3/C=CC(=O)C=C3O)/N2)C4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C24H23N3O5S/c1-31-22-6-4-3-5-17(22)25-24(33)27-19(14-7-10-20(29)23(11-14)32-2)13-18(26-27)16-9-8-15(28)12-21(16)30/h3-12,19,26,29-30H,13H2,1-2H3,(H,25,33)/b18-16+