(2-phenyl-1,3-thiazol-4-yl)methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate Openeye Name: (2-phenylthiazol-4-yl)methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate CAS Name: (5S,7R)-3-acetamido-1-adamantanecarboxylic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl (5S,7R)-3-acetamidoadamantane-1-carboxylate Traditional Name: (5S,7R)-3-acetamidoadamantane-1-carboxylic acid (2-phenylthiazol-4-yl)methyl ester Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=CSC(=N4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)OCC4=CSC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C23H26N2O3S/c1-15(26)25-23-10-16-7-17(11-23)9-22(8-16,14-23)21(27)28-12-19-13-29-20(24-19)18-5-3-2-4-6-18/h2-6,13,16-17H,7-12,14H2,1H3,(H,25,26)/t16-,17+,22?,23?