N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-(phenylmethylsulfanyl)benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-(phenylmethylsulfanyl)benzamide Openeye Name: 2-benzylsulfanyl-N-(4-chloro-2,5-dimethoxy-phenyl)benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(phenylmethylthio)benzamide IUPAC Name: 2-benzylsulfanyl-N-(4-chloro-2,5-dimethoxyphenyl)benzamide Traditional Name: 2-(benzylthio)-N-(4-chloro-2,5-dimethoxy-phenyl)benzamide Formula: C22H20ClNO3S MolecularWeight: 413.9171

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2SCC3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C22H20ClNO3S/c1-26-19-13-18(20(27-2)12-17(19)23)24-22(25)16-10-6-7-11-21(16)28-14-15-8-4-3-5-9-15/h3-13H,14H2,1-2H3,(H,24,25)