3-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C13H14N6OS MolecularWeight: 302.35486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NNC(=N3)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NNC(=N3)N

InChI

InChI=1S/C13H14N6OS/c1-2-8-3-5-9(6-4-8)11-15-10(20-19-11)7-21-13-16-12(14)17-18-13/h3-6H,2,7H2,1H3,(H3,14,16,17,18)