(2S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-1-ethanoyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-acetyl-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-acetyl-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-acetyl-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-acetyl-N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]methyl]pyrrolidine-2-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1C(=O)NCC2=C(N=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(=O)N1CCC[C@H]1C(=O)NCC2=C(N=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H26N4O2/c1-16(27)26-12-5-9-20(26)22(28)24-14-18-8-4-11-23-21(18)25-13-10-17-6-2-3-7-19(17)15-25/h2-4,6-8,11,20H,5,9-10,12-15H2,1H3,(H,24,28)/t20-/m0/s1