2-[[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[3-(2,4-dichlorophenyl)isoxazol-5-yl]methylsulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[3-(2,4-dichlorophenyl)-5-isoxazolyl]methylthio]-N-phenethylacetamide IUPAC Name: 2-[[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]methylsulfanyl]-N-phenethylacetamide Traditional Name: 2-[[3-(2,4-dichlorophenyl)isoxazol-5-yl]methylthio]-N-phenethyl-acetamide Formula: C20H18Cl2N2O2S MolecularWeight: 421.34012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSCC2=CC(=NO2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSCC2=CC(=NO2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H18Cl2N2O2S/c21-15-6-7-17(18(22)10-15)19-11-16(26-24-19)12-27-13-20(25)23-9-8-14-4-2-1-3-5-14/h1-7,10-11H,8-9,12-13H2,(H,23,25)