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

Systemtic Name: 2-[5-(3,6-dihydro-2H-1,4-thiazin-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[5-(3,6-dihydro-2H-1,4-thiazin-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[5-(3,6-dihydro-2H-1,4-thiazin-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[5-(3,6-dihydro-2H-1,4-thiazin-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[5-(3,6-dihydro-2H-1,4-thiazin-5-ylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C23H25N5O3S MolecularWeight: 451.5413

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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=NCCSC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C3)C=CC=C4NC5=NCCSC5)OC

InChI

InChI=1S/C23H25N5O3S/c1-30-19-10-16-18(11-20(19)31-2)26-23(27-22(16)29)28-8-6-15-14(12-28)4-3-5-17(15)25-21-13-32-9-7-24-21/h3-5,10-11H,6-9,12-13H2,1-2H3,(H,24,25)(H,26,27,29)