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

Systemtic Name: 3-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(3-p-cumenyl-1,2,4-oxadiazol-5-yl)methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C14H16N6OS MolecularWeight: 316.38144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N6OS/c1-8(2)9-3-5-10(6-4-9)12-16-11(21-20-12)7-22-14-17-13(15)18-19-14/h3-6,8H,7H2,1-2H3,(H3,15,17,18,19)