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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NOC(=N2)CSC3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NOC(=N2)CSC3=NC=CC=N3

InChI

InChI=1S/C14H12N4OS/c1-2-5-11(6-3-1)9-12-17-13(19-18-12)10-20-14-15-7-4-8-16-14/h1-8H,9-10H2