2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-propyl-ethanamide

Systemtic Name: 2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-propyl-ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(2-methylanilino)-2-oxo-ethyl]-N-propyl-acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[2-keto-2-(o-toluidino)ethyl]-N-propyl-acetamide Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C25H29N3O3/c1-4-14-27(17-24(30)26-22-12-8-5-9-18(22)2)25(31)16-23-21-11-7-6-10-20(21)13-15-28(23)19(3)29/h5-13,15,23H,4,14,16-17H2,1-3H3,(H,26,30)