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

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-(pyridin-4-ylmethylsulfanyl)benzamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-(4-pyridylmethylsulfanyl)benzamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylthio)benzamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)benzamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-(4-pyridylmethylthio)benzamide Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O3S/c1-26-18-12-19(27-2)17(11-16(18)22)24-21(25)15-5-3-4-6-20(15)28-13-14-7-9-23-10-8-14/h3-12H,13H2,1-2H3,(H,24,25)