2-[(1R)-1-[3-(3-imidazol-1-ylpropyl)-4-oxidanylidene-quinazolin-2-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[(1R)-1-[3-(3-imidazol-1-ylpropyl)-4-oxidanylidene-quinazolin-2-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[(1R)-1-[3-(3-imidazol-1-ylpropyl)-4-oxo-quinazolin-2-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[(1R)-1-[3-[3-(1-imidazolyl)propyl]-4-oxo-2-quinazolinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[(1R)-1-[3-(3-imidazol-1-ylpropyl)-4-oxoquinazolin-2-yl]propyl]isoindole-1,3-dione Traditional Name: 2-[(1R)-1-[3-(3-imidazol-1-ylpropyl)-4-keto-quinazolin-2-yl]propyl]isoindoline-1,3-quinone Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1CCCN3C=CN=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC[C@H](C1=NC2=CC=CC=C2C(=O)N1CCCN3C=CN=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H23N5O3/c1-2-21(30-24(32)17-8-3-4-9-18(17)25(30)33)22-27-20-11-6-5-10-19(20)23(31)29(22)14-7-13-28-15-12-26-16-28/h3-6,8-12,15-16,21H,2,7,13-14H2,1H3/t21-/m1/s1