2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C22H31N5O4S2 MolecularWeight: 493.64264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OCC)C4CC4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OCC)C4CC4

InChI

InChI=1S/C22H31N5O4S2/c1-3-27-21(16-8-9-16)24-25-22(27)32-15-20(28)23-18-14-17(10-11-19(18)31-4-2)33(29,30)26-12-6-5-7-13-26/h10-11,14,16H,3-9,12-13,15H2,1-2H3,(H,23,28)