N-[3-[ethyl(phenyl)amino]propyl]-3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]propanamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]propanamide Openeye Name: N-[3-(N-ethylanilino)propyl]-3-[[2-(1-oxo-2-isoquinolyl)acetyl]amino]propanamide CAS Name: N-[3-(N-ethylanilino)propyl]-3-[[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]amino]propanamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-3-[[2-(1-oxoisoquinolin-2-yl)acetyl]amino]propanamide Traditional Name: N-[3-(N-ethylanilino)propyl]-3-[[2-(1-keto-2-isoquinolyl)acetyl]amino]propionamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)CCNC(=O)CN1C=CC2=CC=CC=C2C1=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CCCNC(=O)CCNC(=O)CN1C=CC2=CC=CC=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C25H30N4O3/c1-2-28(21-10-4-3-5-11-21)17-8-15-26-23(30)13-16-27-24(31)19-29-18-14-20-9-6-7-12-22(20)25(29)32/h3-7,9-12,14,18H,2,8,13,15-17,19H2,1H3,(H,26,30)(H,27,31)