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

Systemtic Name: 2-[2-azanyl-4-(1,3-dihydroisoindol-2-ylcarbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)-N-methyl-benzamide Openeye Name: 2-[2-amino-4-(isoindoline-2-carbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)-N-methyl-benzamide CAS Name: 2-[2-amino-4-[1,3-dihydroisoindol-2-yl(oxo)methyl]-6-quinazolinyl]-N-(2-hydroxyethyl)-N-methylbenzamide IUPAC Name: 2-[2-amino-4-(1,3-dihydroisoindole-2-carbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)-N-methylbenzamide Traditional Name: 2-[2-amino-4-(isoindoline-2-carbonyl)quinazolin-6-yl]-N-(2-hydroxyethyl)-N-methyl-benzamide Formula: C27H25N5O3 MolecularWeight: 467.5191

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)C(=O)C1=CC=CC=C1C2=CC3=C(C=C2)N=C(N=C3C(=O)N4CC5=CC=CC=C5C4)N

Isomeric SMILES

CN(CCO)C(=O)C1=CC=CC=C1C2=CC3=C(C=C2)N=C(N=C3C(=O)N4CC5=CC=CC=C5C4)N

InChI

InChI=1S/C27H25N5O3/c1-31(12-13-33)25(34)21-9-5-4-8-20(21)17-10-11-23-22(14-17)24(30-27(28)29-23)26(35)32-15-18-6-2-3-7-19(18)16-32/h2-11,14,33H,12-13,15-16H2,1H3,(H2,28,29,30)