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

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(ethylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[[5-(ethylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-[(ethylthio)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[[5-(ethylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[[5-[(ethylthio)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]ethanone Formula: C14H16BrN3OS2 MolecularWeight: 386.33034

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=NN=C(N1C)SCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCSCC1=NN=C(N1C)SCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H16BrN3OS2/c1-3-20-9-13-16-17-14(18(13)2)21-8-12(19)10-4-6-11(15)7-5-10/h4-7H,3,8-9H2,1-2H3