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5-(4-tert-butylphenyl)-3-methylsulfanyl-1H-1,2,4-triazole

5-(4-tert-butylphenyl)-3-methylsulfanyl-1H-1,2,4-triazole

Systemtic Name:5-(4-tert-butylphenyl)-3-methylsulfanyl-1H-1,2,4-triazole
Openeye Name:5-(4-tert-butylphenyl)-3-methylsulfanyl-1H-1,2,4-triazole
CAS Name:5-(4-tert-butylphenyl)-3-(methylthio)-1H-1,2,4-triazole
IUPAC Name:5-(4-tert-butylphenyl)-3-methylsulfanyl-1H-1,2,4-triazole
Traditional Name:5-(4-tert-butylphenyl)-3-(methylthio)-1H-1,2,4-triazole
Formula: C13H17N3S
MolecularWeight: 247.35918
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)SC


Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)SC


InChI

InChI=1S/C13H17N3S/c1-13(2,3)10-7-5-9(6-8-10)11-14-12(17-4)16-15-11/h5-8H,1-4H3,(H,14,15,16)


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