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

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[(3-bromophenyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(3-bromobenzyl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C9H9BrN4S MolecularWeight: 285.16356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=NNC(=N2)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=NNC(=N2)N

InChI

InChI=1S/C9H9BrN4S/c10-7-3-1-2-6(4-7)5-15-9-12-8(11)13-14-9/h1-4H,5H2,(H3,11,12,13,14)