4-[(2-methyl-2-phenyl-propanoyl)amino]-N-(1,3-thiazol-5-ylmethyl)adamantane-1-carboxamide

Systemtic Name: 4-[(2-methyl-2-phenyl-propanoyl)amino]-N-(1,3-thiazol-5-ylmethyl)adamantane-1-carboxamide Openeye Name: 4-[(2-methyl-2-phenyl-propanoyl)amino]-N-(thiazol-5-ylmethyl)adamantane-1-carboxamide CAS Name: 4-[(2-methyl-1-oxo-2-phenylpropyl)amino]-N-(5-thiazolylmethyl)-1-adamantanecarboxamide IUPAC Name: 4-[(2-methyl-2-phenylpropanoyl)amino]-N-(1,3-thiazol-5-ylmethyl)adamantane-1-carboxamide Traditional Name: 4-[(2-methyl-2-phenyl-propanoyl)amino]-N-(thiazol-5-ylmethyl)adamantane-1-carboxamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)NC2C3CC4CC2CC(C4)(C3)C(=O)NCC5=CN=CS5

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)NC2C3CC4CC2CC(C4)(C3)C(=O)NCC5=CN=CS5

InChI

InChI=1S/C25H31N3O2S/c1-24(2,19-6-4-3-5-7-19)22(29)28-21-17-8-16-9-18(21)12-25(10-16,11-17)23(30)27-14-20-13-26-15-31-20/h3-7,13,15-18,21H,8-12,14H2,1-2H3,(H,27,30)(H,28,29)