2-phenyl-5-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,4-oxadiazole

Systemtic Name: 2-phenyl-5-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,4-oxadiazole Openeye Name: 2-phenyl-5-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3,4-oxadiazole CAS Name: 2-phenyl-5-[[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]methyl]-1,3,4-oxadiazole IUPAC Name: 2-phenyl-5-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,4-oxadiazole Traditional Name: 2-phenyl-5-[[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-1,3,4-oxadiazole Formula: C16H12N6OS MolecularWeight: 336.37108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(O2)CSC3=NNC(=N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(O2)CSC3=NNC(=N3)C4=CC=NC=C4

InChI

InChI=1S/C16H12N6OS/c1-2-4-12(5-3-1)15-21-19-13(23-15)10-24-16-18-14(20-22-16)11-6-8-17-9-7-11/h1-9H,10H2,(H,18,20,22)