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

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazol-4-amine CAS Name: 3-[(3-bromophenyl)methylthio]-5-phenyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-bromobenzyl)thio]-5-phenyl-1,2,4-triazol-4-yl]amine Formula: C15H13BrN4S MolecularWeight: 361.25952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C15H13BrN4S/c16-13-8-4-5-11(9-13)10-21-15-19-18-14(20(15)17)12-6-2-1-3-7-12/h1-9H,10,17H2