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

Systemtic Name: 2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-[3-(propan-2-ylcarbamoylamino)phenyl]ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(isopropylcarbamoylamino)phenyl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(propan-2-ylcarbamoylamino)phenyl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[3-(isopropylcarbamoylamino)phenyl]acetamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=CC(=C1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C23H26N4O3/c1-15(2)24-23(30)26-19-9-6-8-18(13-19)25-22(29)14-21-20-10-5-4-7-17(20)11-12-27(21)16(3)28/h4-13,15,21H,14H2,1-3H3,(H,25,29)(H2,24,26,30)