5-[[6-methoxy-7-(pyridin-4-ylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenol hydrochloride

Systemtic Name: 5-[[6-methoxy-7-(pyridin-4-ylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenol hydrochloride Openeye Name: 5-[[6-methoxy-7-(4-pyridylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenol hydrochloride CAS Name: 5-[[6-methoxy-7-(pyridin-4-ylmethoxy)-4-quinazolinyl]amino]-2-methylphenol hydrochloride IUPAC Name: 5-[[6-methoxy-7-(pyridin-4-ylmethoxy)quinazolin-4-yl]amino]-2-methylphenol hydrochloride Traditional Name: 5-[[6-methoxy-7-(4-pyridylmethoxy)quinazolin-4-yl]amino]-2-methyl-phenol hydrochloride Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CC=NC=C4)O.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CC=NC=C4)O.Cl

InChI

InChI=1S/C22H20N4O3.ClH/c1-14-3-4-16(9-19(14)27)26-22-17-10-20(28-2)21(11-18(17)24-13-25-22)29-12-15-5-7-23-8-6-15;/h3-11,13,27H,12H2,1-2H3,(H,24,25,26);1H