2-[3-(1-methylsulfonylpiperidin-3-yl)-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[3-(1-methylsulfonylpiperidin-3-yl)-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[3-(1-methylsulfonyl-3-piperidyl)-5-oxo-4-(2-thienyl)-1,2,4-triazol-1-yl]-N-phenyl-acetamide CAS Name: 2-[3-(1-methylsulfonyl-3-piperidinyl)-5-oxo-4-thiophen-2-yl-1,2,4-triazol-1-yl]-N-phenylacetamide IUPAC Name: 2-[3-(1-methylsulfonylpiperidin-3-yl)-5-oxo-4-thiophen-2-yl-1,2,4-triazol-1-yl]-N-phenylacetamide Traditional Name: 2-[5-keto-3-(1-mesyl-3-piperidyl)-4-(2-thienyl)-1,2,4-triazol-1-yl]-N-phenyl-acetamide Formula: C20H23N5O4S2 MolecularWeight: 461.55772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C2=NN(C(=O)N2C3=CC=CS3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCCC(C1)C2=NN(C(=O)N2C3=CC=CS3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H23N5O4S2/c1-31(28,29)23-11-5-7-15(13-23)19-22-24(20(27)25(19)18-10-6-12-30-18)14-17(26)21-16-8-3-2-4-9-16/h2-4,6,8-10,12,15H,5,7,11,13-14H2,1H3,(H,21,26)