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

Systemtic Name: 4-phenethyl-3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-phenethyl-3-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-phenethyl-3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-phenethyl-3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-phenethyl-3-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methylthio]-1H-1,2,4-triazol-5-one Formula: C17H15N5O2S2 MolecularWeight: 385.4633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)NN=C2SCC3=NOC(=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)NN=C2SCC3=NOC(=N3)C4=CC=CS4

InChI

InChI=1S/C17H15N5O2S2/c23-16-19-20-17(22(16)9-8-12-5-2-1-3-6-12)26-11-14-18-15(24-21-14)13-7-4-10-25-13/h1-7,10H,8-9,11H2,(H,19,23)