5-(4-methylphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-(4-methylphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(p-tolyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 5-(4-methylphenyl)-3-[(2-pyrimidinylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-methylphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 5-(p-tolyl)-3-[(2-pyrimidylthio)methyl]-1,2,4-oxadiazole Formula: C14H12N4OS MolecularWeight: 284.33628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NC=CC=N3

InChI

InChI=1S/C14H12N4OS/c1-10-3-5-11(6-4-10)13-17-12(18-19-13)9-20-14-15-7-2-8-16-14/h2-8H,9H2,1H3