N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-pyridin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-pyridin-4-ylsulfanyl-ethanamide Openeye Name: N-[[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl]-2-(4-pyridylsulfanyl)acetamide CAS Name: N-[[5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl]-2-(pyridin-4-ylthio)acetamide IUPAC Name: N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-pyridin-4-ylsulfanylacetamide Traditional Name: N-[[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl]-2-(4-pyridylthio)acetamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)CNC(=O)CSC3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)CNC(=O)CSC3=CC=NC=C3)OC

InChI

InChI=1S/C19H19N3O4S/c1-24-16-4-3-13(9-18(16)25-2)17-10-14(22-26-17)11-21-19(23)12-27-15-5-7-20-8-6-15/h3-10H,11-12H2,1-2H3,(H,21,23)