(4S)-4-(3-morpholin-4-ylpropyliminomethyl)-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-4-(3-morpholin-4-ylpropyliminomethyl)-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-(3-morpholinopropyliminomethyl)-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-[3-(4-morpholinyl)propyliminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-(3-morpholin-4-ylpropyliminomethyl)-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-(3-morpholinopropyliminomethyl)-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

C1COCCN1CCCN=C[C@@H]2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C22H24N4O3/c27-21-18-7-2-1-6-17(18)19(22(28)26(21)20-8-3-4-10-24-20)16-23-9-5-11-25-12-14-29-15-13-25/h1-4,6-8,10,16,19H,5,9,11-15H2/t19-/m1/s1