3-(3,4-dimethoxyphenyl)-5-(pyridin-2-ylsulfanylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-(pyridin-2-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-(2-pyridylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(2-pyridinylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-(pyridin-2-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-[(2-pyridylthio)methyl]-1,2,4-oxadiazole Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=CC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=CC=CC=N3)OC

InChI

InChI=1S/C16H15N3O3S/c1-20-12-7-6-11(9-13(12)21-2)16-18-14(22-19-16)10-23-15-5-3-4-8-17-15/h3-9H,10H2,1-2H3