5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 5-(4-chlorophenyl)-3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-chlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 5-(4-chlorophenyl)-3-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1,2,4-oxadiazole Formula: C15H13ClN4OS MolecularWeight: 332.80792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NOC(=N2)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NOC(=N2)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C15H13ClN4OS/c1-9-7-10(2)18-15(17-9)22-8-13-19-14(21-20-13)11-3-5-12(16)6-4-11/h3-7H,8H2,1-2H3