4-methyl-5-phenethylsulfanyl-1,2,4-triazol-3-amine

Systemtic Name: 4-methyl-5-phenethylsulfanyl-1,2,4-triazol-3-amine Openeye Name: 4-methyl-5-phenethylsulfanyl-1,2,4-triazol-3-amine CAS Name: 4-methyl-5-(phenethylthio)-1,2,4-triazol-3-amine IUPAC Name: 4-methyl-5-phenethylsulfanyl-1,2,4-triazol-3-amine Traditional Name: [4-methyl-5-(phenethylthio)-1,2,4-triazol-3-yl]amine Formula: C11H14N4S MolecularWeight: 234.32066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC2=CC=CC=C2)N

Isomeric SMILES

CN1C(=NN=C1SCCC2=CC=CC=C2)N

InChI

InChI=1S/C11H14N4S/c1-15-10(12)13-14-11(15)16-8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13)