1-(1-adamantylcarbonyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[4-(2-methylthiazol-4-yl)phenyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[4-(2-methyl-4-thiazolyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[4-(2-methylthiazol-4-yl)phenyl]pyrrolidine-2-carboxamide Formula: C26H31N3O2S MolecularWeight: 449.60824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H31N3O2S/c1-16-27-22(15-32-16)20-4-6-21(7-5-20)28-24(30)23-3-2-8-29(23)25(31)26-12-17-9-18(13-26)11-19(10-17)14-26/h4-7,15,17-19,23H,2-3,8-14H2,1H3,(H,28,30)