N-(4-bromophenyl)-2-[[5-(4-ethyl-5-methyl-thiophen-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[5-(4-ethyl-5-methyl-thiophen-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[[5-(4-ethyl-5-methyl-3-thienyl)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[[5-(4-ethyl-5-methyl-3-thiophenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[[5-(4-ethyl-5-methylthiophen-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromophenyl)-2-[[5-(4-ethyl-5-methyl-3-thienyl)-4-isopropyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H23BrN4OS2 MolecularWeight: 479.45682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCC1=C(SC=C1C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H23BrN4OS2/c1-5-16-13(4)27-10-17(16)19-23-24-20(25(19)12(2)3)28-11-18(26)22-15-8-6-14(21)7-9-15/h6-10,12H,5,11H2,1-4H3,(H,22,26)