2-[[2,5-bis(fluoranyl)phenoxy]methyl]-N-(4-chloranyl-2,5-dimethoxy-phenyl)morpholine-4-carbothioamide

Systemtic Name: 2-[[2,5-bis(fluoranyl)phenoxy]methyl]-N-(4-chloranyl-2,5-dimethoxy-phenyl)morpholine-4-carbothioamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[(2,5-difluorophenoxy)methyl]morpholine-4-carbothioamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2,5-difluorophenoxy)methyl]-4-morpholinecarbothioamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(2,5-difluorophenoxy)methyl]morpholine-4-carbothioamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[(2,5-difluorophenoxy)methyl]morpholine-4-carbothioamide Formula: C20H21ClF2N2O4S MolecularWeight: 458.906546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)N2CCOC(C2)COC3=C(C=CC(=C3)F)F)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)N2CCOC(C2)COC3=C(C=CC(=C3)F)F)OC)Cl

InChI

InChI=1S/C20H21ClF2N2O4S/c1-26-17-9-16(19(27-2)8-14(17)21)24-20(30)25-5-6-28-13(10-25)11-29-18-7-12(22)3-4-15(18)23/h3-4,7-9,13H,5-6,10-11H2,1-2H3,(H,24,30)