N-[3-[3-(dimethylamino)propylcarbamoyl]-4-piperidin-1-yl-phenyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[3-(dimethylamino)propylcarbamoyl]-4-piperidin-1-yl-phenyl]adamantane-1-carboxamide Openeye Name: N-[3-[3-(dimethylamino)propylcarbamoyl]-4-(1-piperidyl)phenyl]adamantane-1-carboxamide CAS Name: N-[3-[[3-(dimethylamino)propylamino]-oxomethyl]-4-(1-piperidinyl)phenyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[3-(dimethylamino)propylcarbamoyl]-4-piperidin-1-ylphenyl]adamantane-1-carboxamide Traditional Name: N-[3-[3-(dimethylamino)propylcarbamoyl]-4-piperidino-phenyl]adamantane-1-carboxamide Formula: C28H42N4O2 MolecularWeight: 466.65868

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=C(C=CC(=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)N5CCCCC5

Isomeric SMILES

CN(C)CCCNC(=O)C1=C(C=CC(=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)N5CCCCC5

InChI

InChI=1S/C28H42N4O2/c1-31(2)10-6-9-29-26(33)24-16-23(7-8-25(24)32-11-4-3-5-12-32)30-27(34)28-17-20-13-21(18-28)15-22(14-20)19-28/h7-8,16,20-22H,3-6,9-15,17-19H2,1-2H3,(H,29,33)(H,30,34)