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

Systemtic Name: 5-(pyrimidin-2-ylsulfanylmethyl)-3-(thiophen-3-ylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(pyrimidin-2-ylsulfanylmethyl)-3-(3-thienylmethyl)-1,2,4-oxadiazole CAS Name: 5-[(2-pyrimidinylthio)methyl]-3-(3-thiophenylmethyl)-1,2,4-oxadiazole IUPAC Name: 5-(pyrimidin-2-ylsulfanylmethyl)-3-(thiophen-3-ylmethyl)-1,2,4-oxadiazole Traditional Name: 5-[(2-pyrimidylthio)methyl]-3-(3-thenyl)-1,2,4-oxadiazole Formula: C12H10N4OS2 MolecularWeight: 290.364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC2=NC(=NO2)CC3=CSC=C3

Isomeric SMILES

C1=CN=C(N=C1)SCC2=NC(=NO2)CC3=CSC=C3

InChI

InChI=1S/C12H10N4OS2/c1-3-13-12(14-4-1)19-8-11-15-10(16-17-11)6-9-2-5-18-7-9/h1-5,7H,6,8H2