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

Systemtic Name: 5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-methyl-1,2,4-oxadiazole Openeye Name: 5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-methyl-1,2,4-oxadiazole CAS Name: 5-[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-3-methyl-1,2,4-oxadiazole IUPAC Name: 5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-methyl-1,2,4-oxadiazole Traditional Name: 5-[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]phenyl]-3-methyl-1,2,4-oxadiazole Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C3=NC(=NO3)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C3=NC(=NO3)C)C

InChI

InChI=1S/C16H16N4OS/c1-10-8-11(2)18-16(17-10)22-9-13-4-6-14(7-5-13)15-19-12(3)20-21-15/h4-8H,9H2,1-3H3