2-[2-azanyl-4-(1,3-dihydroisoindol-2-ylcarbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)benzenesulfonamide

Systemtic Name: 2-[2-azanyl-4-(1,3-dihydroisoindol-2-ylcarbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)benzenesulfonamide Openeye Name: 2-[2-amino-4-(isoindoline-2-carbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)benzenesulfonamide CAS Name: 2-[2-amino-4-[1,3-dihydroisoindol-2-yl(oxo)methyl]-6-quinazolinyl]-N-(2-hydroxyethyl)benzenesulfonamide IUPAC Name: 2-[2-amino-4-(1,3-dihydroisoindole-2-carbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)benzenesulfonamide Traditional Name: 2-[2-amino-4-(isoindoline-2-carbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)benzenesulfonamide Formula: C25H23N5O4S MolecularWeight: 489.54622

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1C(=O)C3=NC(=NC4=C3C=C(C=C4)C5=CC=CC=C5S(=O)(=O)NCCO)N

Isomeric SMILES

C1C2=CC=CC=C2CN1C(=O)C3=NC(=NC4=C3C=C(C=C4)C5=CC=CC=C5S(=O)(=O)NCCO)N

InChI

InChI=1S/C25H23N5O4S/c26-25-28-21-10-9-16(19-7-3-4-8-22(19)35(33,34)27-11-12-31)13-20(21)23(29-25)24(32)30-14-17-5-1-2-6-18(17)15-30/h1-10,13,27,31H,11-12,14-15H2,(H2,26,28,29)