3,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: 3,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]adamantane-1-carboxamide Openeye Name: 3,5-dimethyl-N-[[2-(morpholinosulfonylmethyl)phenyl]methyl]adamantane-1-carboxamide CAS Name: 3,5-dimethyl-N-[[2-(4-morpholinylsulfonylmethyl)phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: 3,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]adamantane-1-carboxamide Traditional Name: 3,5-dimethyl-N-[2-(morpholinosulfonylmethyl)benzyl]adamantane-1-carboxamide Formula: C25H36N2O4S MolecularWeight: 460.62934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C(=O)NCC4=CC=CC=C4CS(=O)(=O)N5CCOCC5)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)C(=O)NCC4=CC=CC=C4CS(=O)(=O)N5CCOCC5)C

InChI

InChI=1S/C25H36N2O4S/c1-23-11-19-12-24(2,16-23)18-25(13-19,17-23)22(28)26-14-20-5-3-4-6-21(20)15-32(29,30)27-7-9-31-10-8-27/h3-6,19H,7-18H2,1-2H3,(H,26,28)