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

Systemtic Name: (5S,7R)-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-3-hydroxy-N-(5-methyl-4-phenyl-thiazol-2-yl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-hydroxy-N-(5-methyl-4-phenyl-2-thiazolyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-hydroxy-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-hydroxy-N-(5-methyl-4-phenyl-thiazol-2-yl)adamantane-1-carboxamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O2S/c1-13-17(16-5-3-2-4-6-16)22-19(26-13)23-18(24)20-8-14-7-15(9-20)11-21(25,10-14)12-20/h2-6,14-15,25H,7-12H2,1H3,(H,22,23,24)/t14-,15+,20?,21?