N-[3-[2-(dimethylamino)-1-oxidanyl-ethyl]-5-(4-fluorophenyl)thiophen-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-[2-(dimethylamino)-1-oxidanyl-ethyl]-5-(4-fluorophenyl)thiophen-2-yl]adamantane-1-carboxamide Openeye Name: N-[3-[2-(dimethylamino)-1-hydroxy-ethyl]-5-(4-fluorophenyl)-2-thienyl]adamantane-1-carboxamide CAS Name: N-[3-[2-(dimethylamino)-1-hydroxyethyl]-5-(4-fluorophenyl)-2-thiophenyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-(dimethylamino)-1-hydroxyethyl]-5-(4-fluorophenyl)thiophen-2-yl]adamantane-1-carboxamide Traditional Name: N-[3-[2-(dimethylamino)-1-hydroxy-ethyl]-5-(4-fluorophenyl)-2-thienyl]adamantane-1-carboxamide Formula: C25H31FN2O2S MolecularWeight: 442.589243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C1=C(SC(=C1)C2=CC=C(C=C2)F)NC(=O)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CN(C)CC(C1=C(SC(=C1)C2=CC=C(C=C2)F)NC(=O)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C25H31FN2O2S/c1-28(2)14-21(29)20-10-22(18-3-5-19(26)6-4-18)31-23(20)27-24(30)25-11-15-7-16(12-25)9-17(8-15)13-25/h3-6,10,15-17,21,29H,7-9,11-14H2,1-2H3,(H,27,30)