N-[4-(dimethylamino)-3-(1-phenylethylcarbamoyl)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(dimethylamino)-3-(1-phenylethylcarbamoyl)phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(dimethylamino)-3-(1-phenylethylcarbamoyl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-(dimethylamino)-3-[oxo-(1-phenylethylamino)methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(dimethylamino)-3-(1-phenylethylcarbamoyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(dimethylamino)-3-(1-phenylethylcarbamoyl)phenyl]adamantane-1-carboxamide Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O2/c1-18(22-7-5-4-6-8-22)29-26(32)24-14-23(9-10-25(24)31(2)3)30-27(33)28-15-19-11-20(16-28)13-21(12-19)17-28/h4-10,14,18-21H,11-13,15-17H2,1-3H3,(H,29,32)(H,30,33)