3-azanyl-N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-5-methyl-adamantane-1-carboxamide

Systemtic Name: 3-azanyl-N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-5-methyl-adamantane-1-carboxamide Openeye Name: 3-amino-N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-5-methyl-adamantane-1-carboxamide CAS Name: 3-amino-N-[1-[2-(4-fluorophenyl)ethyl]-3-pyrrolidinyl]-5-methyl-1-adamantanecarboxamide IUPAC Name: 3-amino-N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-5-methyladamantane-1-carboxamide Traditional Name: 3-amino-N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-5-methyl-adamantane-1-carboxamide Formula: C24H34FN3O MolecularWeight: 399.544663

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)N)C(=O)NC4CCN(C4)CCC5=CC=C(C=C5)F

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)N)C(=O)NC4CCN(C4)CCC5=CC=C(C=C5)F

InChI

InChI=1S/C24H34FN3O/c1-22-10-18-11-23(14-22,16-24(26,12-18)15-22)21(29)27-20-7-9-28(13-20)8-6-17-2-4-19(25)5-3-17/h2-5,18,20H,6-16,26H2,1H3,(H,27,29)