2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-(4-methoxyphenyl)propanamide

Systemtic Name: 2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-(4-methoxyphenyl)propanamide Openeye Name: 2-[[3-(4-chlorophenyl)isoxazol-5-yl]methylsulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: 2-[[3-(4-chlorophenyl)-5-isoxazolyl]methylthio]-N-(4-methoxyphenyl)propanamide IUPAC Name: 2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-(4-methoxyphenyl)propanamide Traditional Name: 2-[[3-(4-chlorophenyl)isoxazol-5-yl]methylthio]-N-(4-methoxyphenyl)propionamide Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)SCC2=CC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC)SCC2=CC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-13(20(24)22-16-7-9-17(25-2)10-8-16)27-12-18-11-19(23-26-18)14-3-5-15(21)6-4-14/h3-11,13H,12H2,1-2H3,(H,22,24)