N-(1-adamantylcarbamoyl)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H27N5O2S2 MolecularWeight: 457.61208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4)C6=CC=CS6

Isomeric SMILES

C1CC1N2C(=NN=C2SCC(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4)C6=CC=CS6

InChI

InChI=1S/C22H27N5O2S2/c28-18(23-20(29)24-22-9-13-6-14(10-22)8-15(7-13)11-22)12-31-21-26-25-19(17-2-1-5-30-17)27(21)16-3-4-16/h1-2,5,13-16H,3-4,6-12H2,(H2,23,24,28,29)