1-(4-bromophenyl)-2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(4-bromophenyl)-2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C15H18BrN3OS MolecularWeight: 368.29192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1CC)SCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCC1=NN=C(N1CC)SCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrN3OS/c1-3-5-14-17-18-15(19(14)4-2)21-10-13(20)11-6-8-12(16)9-7-11/h6-9H,3-5,10H2,1-2H3