1-(1-adamantylcarbonyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[2-methyl-4-(4-methylpiperazino)phenyl]pyrrolidine-2-carboxamide Formula: C28H40N4O2 MolecularWeight: 464.6428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H40N4O2/c1-19-12-23(31-10-8-30(2)9-11-31)5-6-24(19)29-26(33)25-4-3-7-32(25)27(34)28-16-20-13-21(17-28)15-22(14-20)18-28/h5-6,12,20-22,25H,3-4,7-11,13-18H2,1-2H3,(H,29,33)