N-[3-[(4-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]ethanamide

Systemtic Name: N-[3-[(4-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]ethanamide Openeye Name: N-[3-[(4-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]acetamide CAS Name: N-[3-[(4-bromophenyl)methylthio]-1H-1,2,4-triazol-5-yl]acetamide IUPAC Name: N-[3-[(4-bromophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]acetamide Traditional Name: N-[3-[(4-bromobenzyl)thio]-1H-1,2,4-triazol-5-yl]acetamide Formula: C11H11BrN4OS MolecularWeight: 327.20024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=NN1)SCC2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)NC1=NC(=NN1)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C11H11BrN4OS/c1-7(17)13-10-14-11(16-15-10)18-6-8-2-4-9(12)5-3-8/h2-5H,6H2,1H3,(H2,13,14,15,16,17)