2-[(2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-7-yl)sulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-7-yl)sulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole Openeye Name: 2-[(2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-7-yl)sulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole CAS Name: 2-[(2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-7-yl)thio]-5-(phenoxymethyl)-1,3,4-oxadiazole IUPAC Name: 2-[(2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-7-yl)sulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole Traditional Name: 2-[(2,5-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium-7-yl)thio]-5-(phenoxymethyl)-1,3,4-oxadiazole Formula: C16H15N6O2S+ MolecularWeight: 355.3943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C(=N1)N=C(N2)C)SC3=NN=C(O3)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=[N+]2C(=N1)N=C(N2)C)SC3=NN=C(O3)COC4=CC=CC=C4

InChI

InChI=1S/C16H14N6O2S/c1-10-8-14(22-15(17-10)18-11(2)21-22)25-16-20-19-13(24-16)9-23-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3/p+1