N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)adamantane-1-carboxamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)adamantane-1-carboxamide Openeye Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]adamantane-1-carboxamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-(phenylmethyl)-1-adamantanecarboxamide IUPAC Name: N-benzyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]adamantane-1-carboxamide Traditional Name: N-benzyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]adamantane-1-carboxamide Formula: C30H33FN2O MolecularWeight: 456.594223

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)N(CC4=CC=CC=C4)CC5=CC=CN5CC6=CC(=CC=C6)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N(CC4=CC=CC=C4)CC5=CC=CN5CC6=CC(=CC=C6)F

InChI

InChI=1S/C30H33FN2O/c31-27-9-4-8-23(15-27)20-32-11-5-10-28(32)21-33(19-22-6-2-1-3-7-22)29(34)30-16-24-12-25(17-30)14-26(13-24)18-30/h1-11,15,24-26H,12-14,16-21H2