3-methyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-methyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isopropoxyphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine CAS Name: 3-methyl-5-[(4-propan-2-yloxyphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-methyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isopropoxybenzyl)thio]-5-methyl-1,2,4-triazol-4-yl]amine Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4OS/c1-9(2)18-12-6-4-11(5-7-12)8-19-13-16-15-10(3)17(13)14/h4-7,9H,8,14H2,1-3H3