3-methyl-5-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-methyl-5-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isobutoxyphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine CAS Name: 3-methyl-5-[[4-(2-methylpropoxy)phenyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-methyl-5-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isobutoxybenzyl)thio]-5-methyl-1,2,4-triazol-4-yl]amine Formula: C14H20N4OS MolecularWeight: 292.3998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC2=CC=C(C=C2)OCC(C)C

Isomeric SMILES

CC1=NN=C(N1N)SCC2=CC=C(C=C2)OCC(C)C

InChI

InChI=1S/C14H20N4OS/c1-10(2)8-19-13-6-4-12(5-7-13)9-20-14-17-16-11(3)18(14)15/h4-7,10H,8-9,15H2,1-3H3