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

Systemtic Name: 3-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isobutoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[[4-(2-methylpropoxy)phenyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[[4-(2-methylpropoxy)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isobutoxybenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CSC2=NN=CN2N

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CSC2=NN=CN2N

InChI

InChI=1S/C13H18N4OS/c1-10(2)7-18-12-5-3-11(4-6-12)8-19-13-16-15-9-17(13)14/h3-6,9-10H,7-8,14H2,1-2H3