N-[2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[4-(o-tolylmethyl)piperazin-1-yl]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-[4-(2-methylbenzyl)piperazino]ethyl]adamantane-1-carboxamide Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H35N3O2/c1-18-4-2-3-5-22(18)17-27-6-8-28(9-7-27)23(29)16-26-24(30)25-13-19-10-20(14-25)12-21(11-19)15-25/h2-5,19-21H,6-17H2,1H3,(H,26,30)