2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(1-imidazolylmethyl)phenyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(imidazol-1-ylmethyl)phenyl]acetamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C23H22N4O2/c1-17(28)27-11-9-19-6-2-3-8-21(19)22(27)14-23(29)25-20-7-4-5-18(13-20)15-26-12-10-24-16-26/h2-13,16,22H,14-15H2,1H3,(H,25,29)