3-tert-butyl-5-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-tert-butyl-5-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-tert-butyl-1,2,4-triazol-4-amine CAS Name: 3-tert-butyl-5-[[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-tert-butyl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-benzyl-1,2,4-oxadiazol-5-yl)methylthio]-5-tert-butyl-1,2,4-triazol-4-yl]amine Formula: C16H20N6OS MolecularWeight: 344.4346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1N)SCC2=NC(=NO2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN=C(N1N)SCC2=NC(=NO2)CC3=CC=CC=C3

InChI

InChI=1S/C16H20N6OS/c1-16(2,3)14-19-20-15(22(14)17)24-10-13-18-12(21-23-13)9-11-7-5-4-6-8-11/h4-8H,9-10,17H2,1-3H3