(3E)-5-(3-methoxy-4-oxidanyl-phenyl)-N-(4-methylphenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)pyrazolidine-1-carbothioamide

Systemtic Name: (3E)-5-(3-methoxy-4-oxidanyl-phenyl)-N-(4-methylphenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)pyrazolidine-1-carbothioamide Openeye Name: (3E)-5-(4-hydroxy-3-methoxy-phenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-N-(p-tolyl)pyrazolidine-1-carbothioamide CAS Name: (3E)-5-(4-hydroxy-3-methoxyphenyl)-N-(4-methylphenyl)-3-(6-oxo-1-cyclohexa-2,4-dienylidene)-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-5-(4-hydroxy-3-methoxyphenyl)-N-(4-methylphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)pyrazolidine-1-carbothioamide Traditional Name: (3E)-5-(4-hydroxy-3-methoxy-phenyl)-3-(6-ketocyclohexa-2,4-dien-1-ylidene)-N-(p-tolyl)pyrazolidine-1-carbothioamide Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N2C(CC(=C3C=CC=CC3=O)N2)C4=CC(=C(C=C4)O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N2C(C/C(=C\3/C=CC=CC3=O)/N2)C4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C24H23N3O3S/c1-15-7-10-17(11-8-15)25-24(31)27-20(16-9-12-22(29)23(13-16)30-2)14-19(26-27)18-5-3-4-6-21(18)28/h3-13,20,26,29H,14H2,1-2H3,(H,25,31)/b19-18+