2-(4-bromanylphenoxy)-N-(3-ethylsulfanyl-1H-1,2,4-triazol-5-yl)ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-(3-ethylsulfanyl-1H-1,2,4-triazol-5-yl)ethanamide Openeye Name: 2-(4-bromophenoxy)-N-(3-ethylsulfanyl-1H-1,2,4-triazol-5-yl)acetamide CAS Name: 2-(4-bromophenoxy)-N-[3-(ethylthio)-1H-1,2,4-triazol-5-yl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-(3-ethylsulfanyl-1H-1,2,4-triazol-5-yl)acetamide Traditional Name: 2-(4-bromophenoxy)-N-[3-(ethylthio)-1H-1,2,4-triazol-5-yl]acetamide Formula: C12H13BrN4O2S MolecularWeight: 357.22622

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NNC(=N1)NC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

CCSC1=NNC(=N1)NC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN4O2S/c1-2-20-12-15-11(16-17-12)14-10(18)7-19-9-5-3-8(13)4-6-9/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18)