1-(1-adamantylcarbonyl)-N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[2-[(2-chlorophenyl)methyl]-3-pyrazolyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[2-(2-chlorobenzyl)pyrazol-3-yl]pyrrolidine-2-carboxamide Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=NN5CC6=CC=CC=C6Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=NN5CC6=CC=CC=C6Cl

InChI

InChI=1S/C26H31ClN4O2/c27-21-5-2-1-4-20(21)16-31-23(7-8-28-31)29-24(32)22-6-3-9-30(22)25(33)26-13-17-10-18(14-26)12-19(11-17)15-26/h1-2,4-5,7-8,17-19,22H,3,6,9-16H2,(H,29,32)