3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)CSC3=NNC(=O)N3CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)CSC3=NNC(=O)N3CCC4=CC=CC=C4

InChI

InChI=1S/C20H19N5O3S/c1-27-16-9-5-8-15(12-16)18-21-17(28-24-18)13-29-20-23-22-19(26)25(20)11-10-14-6-3-2-4-7-14/h2-9,12H,10-11,13H2,1H3,(H,22,26)