N-aminocarbonyl-2-[[5-[(4-bromanylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-aminocarbonyl-2-[[5-[(4-bromanylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-acetamide CAS Name: 2-[[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-carbamoylacetamide IUPAC Name: 2-[[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoylacetamide Traditional Name: 2-[[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-carbamoyl-acetamide Formula: C12H12BrN5O3S MolecularWeight: 386.22438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC2=NC(=NN2)SCC(=O)NC(=O)N)Br

Isomeric SMILES

C1=CC(=CC=C1OCC2=NC(=NN2)SCC(=O)NC(=O)N)Br

InChI

InChI=1S/C12H12BrN5O3S/c13-7-1-3-8(4-2-7)21-5-9-15-12(18-17-9)22-6-10(19)16-11(14)20/h1-4H,5-6H2,(H,15,17,18)(H3,14,16,19,20)