2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonyl-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carbothioamide

Systemtic Name: 2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonyl-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carbothioamide Openeye Name: 2-(3-chloro-2,6-dimethoxy-benzoyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carbothioamide CAS Name: 2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-N-(3,4,5-trimethoxyphenyl)-1-pyrazolidinecarbothioamide IUPAC Name: 2-(3-chloro-2,6-dimethoxybenzoyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carbothioamide Traditional Name: 2-(3-chloro-2,6-dimethoxy-benzoyl)-N-(3,4,5-trimethoxyphenyl)pyrazolidine-1-carbothioamide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=S)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=S)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H26ClN3O6S/c1-28-15-8-7-14(23)19(31-4)18(15)21(27)25-9-6-10-26(25)22(33)24-13-11-16(29-2)20(32-5)17(12-13)30-3/h7-8,11-12H,6,9-10H2,1-5H3,(H,24,33)