[4-(4-azanyl-6-cyclobutyloxy-7-methoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-yl-methanone hydrochloride

Systemtic Name: [4-(4-azanyl-6-cyclobutyloxy-7-methoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-yl-methanone hydrochloride Openeye Name: [4-[4-amino-6-(cyclobutoxy)-7-methoxy-quinazolin-2-yl]-1,4-diazepan-1-yl]-morpholino-methanone hydrochloride CAS Name: [4-(4-amino-6-cyclobutyloxy-7-methoxy-2-quinazolinyl)-1,4-diazepan-1-yl]-(4-morpholinyl)methanone hydrochloride IUPAC Name: [4-(4-amino-6-cyclobutyloxy-7-methoxyquinazolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-ylmethanone hydrochloride Traditional Name: [4-[4-amino-6-(cyclobutoxy)-7-methoxy-quinazolin-2-yl]-1,4-diazepan-1-yl]-morpholino-methanone hydrochloride Formula: C23H33ClN6O4 MolecularWeight: 492.99892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N=C2N)N3CCCN(CC3)C(=O)N4CCOCC4)OC5CCC5.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N=C2N)N3CCCN(CC3)C(=O)N4CCOCC4)OC5CCC5.Cl

InChI

InChI=1S/C23H32N6O4.ClH/c1-31-19-15-18-17(14-20(19)33-16-4-2-5-16)21(24)26-22(25-18)27-6-3-7-28(9-8-27)23(30)29-10-12-32-13-11-29;/h14-16H,2-13H2,1H3,(H2,24,25,26);1H