N-[2-(4-bromanylphenoxy)ethyl]-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-[2-(4-bromanylphenoxy)ethyl]-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide Openeye Name: N-[2-(4-bromophenoxy)ethyl]-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-acetamide CAS Name: N-[2-(4-bromophenoxy)ethyl]-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-methylacetamide IUPAC Name: N-[2-(4-bromophenoxy)ethyl]-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methylacetamide Traditional Name: N-[2-(4-bromophenoxy)ethyl]-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-methyl-acetamide Formula: C22H23BrN4O2S MolecularWeight: 487.41262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Br)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H23BrN4O2S/c1-26(13-14-29-19-11-9-17(23)10-12-19)20(28)15-30-22-25-24-21(16-7-8-16)27(22)18-5-3-2-4-6-18/h2-6,9-12,16H,7-8,13-15H2,1H3