5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]pyrimidine-2-carboxylic acid

Systemtic Name: 5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]pyrimidine-2-carboxylic acid Openeye Name: 5-[[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]pyrimidine-2-carboxylic acid CAS Name: 5-[[6-methoxy-7-[3-(4-morpholinyl)propoxy]-4-quinazolinyl]amino]-2-pyrimidinecarboxylic acid IUPAC Name: 5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]pyrimidine-2-carboxylic acid Traditional Name: 5-[[6-methoxy-7-(3-morpholinopropoxy)quinazolin-4-yl]amino]pyrimidine-2-carboxylic acid Formula: C21H24N6O5 MolecularWeight: 440.45246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)C(=O)O)OCCCN4CCOCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CN=C(N=C3)C(=O)O)OCCCN4CCOCC4

InChI

InChI=1S/C21H24N6O5/c1-30-17-9-15-16(10-18(17)32-6-2-3-27-4-7-31-8-5-27)24-13-25-19(15)26-14-11-22-20(21(28)29)23-12-14/h9-13H,2-8H2,1H3,(H,28,29)(H,24,25,26)