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

Systemtic Name: N-[3-(cyclopropylcarbamoylamino)phenyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(cyclopropylcarbamoylamino)phenyl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-[[(cyclopropylamino)-oxomethyl]amino]phenyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(cyclopropylcarbamoylamino)phenyl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(cyclopropylcarbamoylamino)phenyl]acetamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)NC(=O)NC4CC4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC(=CC=C3)NC(=O)NC4CC4

InChI

InChI=1S/C23H24N4O3/c1-15(28)27-12-11-16-5-2-3-8-20(16)21(27)14-22(29)24-18-6-4-7-19(13-18)26-23(30)25-17-9-10-17/h2-8,11-13,17,21H,9-10,14H2,1H3,(H,24,29)(H2,25,26,30)