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

Systemtic Name: 2-[[5-(4-ethyl-5-methyl-thiophen-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5-(4-ethyl-5-methyl-3-thienyl)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-(4-ethyl-5-methyl-3-thiophenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[5-(4-ethyl-5-methylthiophen-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[5-(4-ethyl-5-methyl-3-thienyl)-4-isopropyl-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C22H28N4OS2 MolecularWeight: 428.61392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C2=NN=C(N2C(C)C)SCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC=C1C2=NN=C(N2C(C)C)SCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N4OS2/c1-5-18-16(4)28-13-19(18)21-24-25-22(26(21)15(2)3)29-14-20(27)23-12-11-17-9-7-6-8-10-17/h6-10,13,15H,5,11-12,14H2,1-4H3,(H,23,27)