6-bromanyl-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-bromo-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-bromo-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]quinazolin-4-one Traditional Name: 6-bromo-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]quinazolin-4-one Formula: C19H16BrN3O2 MolecularWeight: 398.25324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C19H16BrN3O2/c20-15-5-6-17-16(9-15)19(25)23(12-21-17)11-18(24)22-8-7-13-3-1-2-4-14(13)10-22/h1-6,9,12H,7-8,10-11H2