N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C13H15BrN4O2S MolecularWeight: 371.2528

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Br)C(=O)CSC2=NC=NN2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C(=O)CSC2=NC=NN2

InChI

InChI=1S/C13H15BrN4O2S/c1-18(12(19)8-21-13-15-9-16-17-13)6-7-20-11-4-2-10(14)3-5-11/h2-5,9H,6-8H2,1H3,(H,15,16,17)