N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]propanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]propanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[[2-(1-oxo-2-isoquinolyl)acetyl]amino]propanamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]amino]propanamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[[2-(1-oxoisoquinolin-2-yl)acetyl]amino]propanamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[[2-(1-keto-2-isoquinolyl)acetyl]amino]propionamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCNC(=O)CCNC(=O)CN3C=CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCNC(=O)CCNC(=O)CN3C=CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H28N4O3/c30-23(27-13-16-28-14-10-19-5-1-2-7-21(19)17-28)9-12-26-24(31)18-29-15-11-20-6-3-4-8-22(20)25(29)32/h1-8,11,15H,9-10,12-14,16-18H2,(H,26,31)(H,27,30)