2-(2-pyridin-4-ylethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(2-pyridin-4-ylethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[2-(4-pyridyl)ethylsulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-(2-pyridin-4-ylethylthio)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-(2-pyridin-4-ylethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-[2-(4-pyridyl)ethylthio]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCCC3=CC=NC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)SCCC3=CC=NC=C3

InChI

InChI=1S/C18H19N3O4S/c1-22-14-10-13(11-15(23-2)16(14)24-3)17-20-21-18(25-17)26-9-6-12-4-7-19-8-5-12/h4-5,7-8,10-11H,6,9H2,1-3H3