4-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carbonitrile Openeye Name: 4-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carbonitrile CAS Name: 4-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-2,6-dimethyl-5-pyrimidinecarbonitrile IUPAC Name: 4-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2,6-dimethylpyrimidine-5-carbonitrile Traditional Name: 4-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-2,6-dimethyl-pyrimidine-5-carbonitrile Formula: C16H12ClN5OS MolecularWeight: 357.81738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCC2=NC(=NO2)C3=CC(=CC=C3)Cl)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCC2=NC(=NO2)C3=CC(=CC=C3)Cl)C#N

InChI

InChI=1S/C16H12ClN5OS/c1-9-13(7-18)16(20-10(2)19-9)24-8-14-21-15(22-23-14)11-4-3-5-12(17)6-11/h3-6H,8H2,1-2H3