2-[5-(3,4-dihydro-2H-pyrrol-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[5-(3,4-dihydro-2H-pyrrol-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[5-(3,4-dihydro-2H-pyrrol-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[5-(3,4-dihydro-2H-pyrrol-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[5-(3,4-dihydro-2H-pyrrol-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[5-(1-pyrrolin-2-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-1H-quinazolin-4-one Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C3)C=CC=C4NC5=NCCC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C3)C=CC=C4NC5=NCCC5)OC

InChI

InChI=1S/C23H25N5O3/c1-30-19-11-16-18(12-20(19)31-2)26-23(27-22(16)29)28-10-8-15-14(13-28)5-3-6-17(15)25-21-7-4-9-24-21/h3,5-6,11-12H,4,7-10,13H2,1-2H3,(H,24,25)(H,26,27,29)