(5S,7R)-3-acetamido-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-(5-methyl-4-phenyl-thiazol-2-yl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-(5-methyl-4-phenyl-2-thiazolyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-(5-methyl-4-phenyl-thiazol-2-yl)adamantane-1-carboxamide Formula: C23H27N3O2S MolecularWeight: 409.54438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C23CC4CC(C2)CC(C4)(C3)NC(=O)C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)NC(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C23H27N3O2S/c1-14-19(18-6-4-3-5-7-18)24-21(29-14)25-20(28)22-9-16-8-17(10-22)12-23(11-16,13-22)26-15(2)27/h3-7,16-17H,8-13H2,1-2H3,(H,26,27)(H,24,25,28)/t16-,17+,22?,23?