5-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-amine

Systemtic Name: 5-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-amine Openeye Name: 5-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-amine CAS Name: 5-[(4-bromophenyl)methylthio]-4-ethyl-1,2,4-triazol-3-amine IUPAC Name: 5-[(4-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-amine Traditional Name: [5-[(4-bromobenzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]amine Formula: C11H13BrN4S MolecularWeight: 313.21672

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)N

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)N

InChI

InChI=1S/C11H13BrN4S/c1-2-16-10(13)14-15-11(16)17-7-8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3,(H2,13,14)