2-azanyl-5-[2-[[3-(hydroxymethyl)phenyl]amino]-4-pyridin-4-yl-quinazolin-6-yl]pyridine-3-carboxamide

Systemtic Name: 2-azanyl-5-[2-[[3-(hydroxymethyl)phenyl]amino]-4-pyridin-4-yl-quinazolin-6-yl]pyridine-3-carboxamide Openeye Name: 2-amino-5-[2-[3-(hydroxymethyl)anilino]-4-(4-pyridyl)quinazolin-6-yl]pyridine-3-carboxamide CAS Name: 2-amino-5-[2-[3-(hydroxymethyl)anilino]-4-pyridin-4-yl-6-quinazolinyl]-3-pyridinecarboxamide IUPAC Name: 2-amino-5-[2-[3-(hydroxymethyl)anilino]-4-pyridin-4-ylquinazolin-6-yl]pyridine-3-carboxamide Traditional Name: 2-amino-5-[2-(3-methylolanilino)-4-(4-pyridyl)quinazolin-6-yl]nicotinamide Formula: C26H21N7O2 MolecularWeight: 463.49064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC3=C(C=C(C=C3)C4=CC(=C(N=C4)N)C(=O)N)C(=N2)C5=CC=NC=C5)CO

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC3=C(C=C(C=C3)C4=CC(=C(N=C4)N)C(=O)N)C(=N2)C5=CC=NC=C5)CO

InChI

InChI=1S/C26H21N7O2/c27-24-21(25(28)35)12-18(13-30-24)17-4-5-22-20(11-17)23(16-6-8-29-9-7-16)33-26(32-22)31-19-3-1-2-15(10-19)14-34/h1-13,34H,14H2,(H2,27,30)(H2,28,35)(H,31,32,33)