(2S)-2-[[4-(1-adamantyl)phenyl]amino]-N-(methylcarbamoyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[[4-(1-adamantyl)phenyl]amino]-N-(methylcarbamoyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[4-(1-adamantyl)anilino]-N-(methylcarbamoyl)-2-phenyl-acetamide CAS Name: (2S)-2-[4-(1-adamantyl)anilino]-N-(methylcarbamoyl)-2-phenylacetamide IUPAC Name: (2S)-2-[4-(1-adamantyl)anilino]-N-(methylcarbamoyl)-2-phenylacetamide Traditional Name: (2S)-2-[4-(1-adamantyl)anilino]-N-(methylcarbamoyl)-2-phenyl-acetamide Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H31N3O2/c1-27-25(31)29-24(30)23(20-5-3-2-4-6-20)28-22-9-7-21(8-10-22)26-14-17-11-18(15-26)13-19(12-17)16-26/h2-10,17-19,23,28H,11-16H2,1H3,(H2,27,29,30,31)/t17?,18?,19?,23-,26?/m0/s1