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

Systemtic Name: (3E)-5-(4-hydroxyphenyl)-3-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-3-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5-(4-hydroxyphenyl)-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-5-(4-hydroxyphenyl)-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-3-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-5-(4-hydroxyphenyl)-N-phenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-(4-hydroxyphenyl)-N-phenyl-pyrazolidine-1-carbothioamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=CC(=O)C=C2O)C(=S)NC3=CC=CC=C3)C4=CC=C(C=C4)O

Isomeric SMILES

C\1C(N(N/C1=C/2\C=CC(=O)C=C2O)C(=S)NC3=CC=CC=C3)C4=CC=C(C=C4)O

InChI

InChI=1S/C22H19N3O3S/c26-16-8-6-14(7-9-16)20-13-19(18-11-10-17(27)12-21(18)28)24-25(20)22(29)23-15-4-2-1-3-5-15/h1-12,20,24,26,28H,13H2,(H,23,29)/b19-18+