N-(4-bromophenyl)-2-[[5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[[5-ethyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[[5-ethyl-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[[5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromophenyl)-2-[[5-ethyl-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H21BrN4O2S MolecularWeight: 425.34324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC2CCCO2)SCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=NN=C(N1CC2CCCO2)SCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H21BrN4O2S/c1-2-15-20-21-17(22(15)10-14-4-3-9-24-14)25-11-16(23)19-13-7-5-12(18)6-8-13/h5-8,14H,2-4,9-11H2,1H3,(H,19,23)