N-[2-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide

Systemtic Name: N-[2-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Openeye Name: N-[2-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide CAS Name: N-[2-(4-amino-6,7-dimethoxy-2-quinazolinyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide IUPAC Name: N-[2-(4-amino-6,7-dimethoxyquinazolin-2-yl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Traditional Name: N-[2-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC4=C(C3)C=C(C=C4)NS(=O)(=O)C5=CC=CC=C5)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC4=C(C3)C=C(C=C4)NS(=O)(=O)C5=CC=CC=C5)N)OC

InChI

InChI=1S/C25H25N5O4S/c1-33-22-13-20-21(14-23(22)34-2)27-25(28-24(20)26)30-11-10-16-8-9-18(12-17(16)15-30)29-35(31,32)19-6-4-3-5-7-19/h3-9,12-14,29H,10-11,15H2,1-2H3,(H2,26,27,28)