2-[(3R)-3-azanylpyrrolidin-1-yl]-N-[(3-cyano-2-ethyl-naphthalen-1-yl)methyl]-2-(4-fluorophenyl)-N-methyl-ethanamide

Systemtic Name: 2-[(3R)-3-azanylpyrrolidin-1-yl]-N-[(3-cyano-2-ethyl-naphthalen-1-yl)methyl]-2-(4-fluorophenyl)-N-methyl-ethanamide Openeye Name: 2-[(3R)-3-aminopyrrolidin-1-yl]-N-[(3-cyano-2-ethyl-1-naphthyl)methyl]-2-(4-fluorophenyl)-N-methyl-acetamide CAS Name: 2-[(3R)-3-amino-1-pyrrolidinyl]-N-[(3-cyano-2-ethyl-1-naphthalenyl)methyl]-2-(4-fluorophenyl)-N-methylacetamide IUPAC Name: 2-[(3R)-3-aminopyrrolidin-1-yl]-N-[(3-cyano-2-ethylnaphthalen-1-yl)methyl]-2-(4-fluorophenyl)-N-methylacetamide Traditional Name: 2-[(3R)-3-aminopyrrolidino]-N-[(3-cyano-2-ethyl-1-naphthyl)methyl]-2-(4-fluorophenyl)-N-methyl-acetamide Formula: C27H29FN4O MolecularWeight: 444.543763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2C=C1C#N)CN(C)C(=O)C(C3=CC=C(C=C3)F)N4CCC(C4)N

Isomeric SMILES

CCC1=C(C2=CC=CC=C2C=C1C#N)CN(C)C(=O)C(C3=CC=C(C=C3)F)N4CC[C@H](C4)N

InChI

InChI=1S/C27H29FN4O/c1-3-23-20(15-29)14-19-6-4-5-7-24(19)25(23)17-31(2)27(33)26(32-13-12-22(30)16-32)18-8-10-21(28)11-9-18/h4-11,14,22,26H,3,12-13,16-17,30H2,1-2H3/t22-,26?/m1/s1