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

Systemtic Name: 4-propyl-3-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-propyl-3-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-propyl-3-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-propyl-3-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-propyl-3-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-1,2,4-triazol-5-one Formula: C12H13N5O2S2 MolecularWeight: 323.39392

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=NC(=NO2)C3=CSC=C3

InChI

InChI=1S/C12H13N5O2S2/c1-2-4-17-11(18)14-15-12(17)21-7-9-13-10(16-19-9)8-3-5-20-6-8/h3,5-6H,2,4,7H2,1H3,(H,14,18)