3-(3-bromophenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(3-bromophenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-benzylsulfanyl-5-(3-bromophenyl)-1,2,4-triazol-4-amine CAS Name: 3-(3-bromophenyl)-5-(phenylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-benzylsulfanyl-5-(3-bromophenyl)-1,2,4-triazol-4-amine Traditional Name: [3-(benzylthio)-5-(3-bromophenyl)-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)CSC2=NN=C(N2N)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2N)C3=CC(=CC=C3)Br

InChI

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