2-[3-propyl-5-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1,2,4-triazol-4-yl]ethanoate

Systemtic Name: 2-[3-propyl-5-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1,2,4-triazol-4-yl]ethanoate Openeye Name: 2-[3-propyl-5-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,2,4-triazol-4-yl]acetate CAS Name: 2-[3-propyl-5-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1,2,4-triazol-4-yl]acetate IUPAC Name: 2-[3-propyl-5-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1,2,4-triazol-4-yl]acetate Traditional Name: 2-[3-propyl-5-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]-1,2,4-triazol-4-yl]acetate Formula: C14H14N5O3S2- MolecularWeight: 364.42266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1CC(=O)[O-])SCC2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

CCCC1=NN=C(N1CC(=O)[O-])SCC2=NC(=NO2)C3=CSC=C3

InChI

InChI=1S/C14H15N5O3S2/c1-2-3-10-16-17-14(19(10)6-12(20)21)24-8-11-15-13(18-22-11)9-4-5-23-7-9/h4-5,7H,2-3,6,8H2,1H3,(H,20,21)/p-1