3-[1-(2-chloranyl-6,7-diethoxy-quinazolin-4-yl)piperidin-4-yl]-1,6-dimethyl-quinazoline-2,4-dione

Systemtic Name: 3-[1-(2-chloranyl-6,7-diethoxy-quinazolin-4-yl)piperidin-4-yl]-1,6-dimethyl-quinazoline-2,4-dione Openeye Name: 3-[1-(2-chloro-6,7-diethoxy-quinazolin-4-yl)-4-piperidyl]-1,6-dimethyl-quinazoline-2,4-dione CAS Name: 3-[1-(2-chloro-6,7-diethoxy-4-quinazolinyl)-4-piperidinyl]-1,6-dimethylquinazoline-2,4-dione IUPAC Name: 3-[1-(2-chloro-6,7-diethoxyquinazolin-4-yl)piperidin-4-yl]-1,6-dimethylquinazoline-2,4-dione Traditional Name: 3-[1-(2-chloro-6,7-diethoxy-quinazolin-4-yl)-4-piperidyl]-1,6-dimethyl-quinazoline-2,4-quinone Formula: C27H30ClN5O4 MolecularWeight: 524.0112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCC(CC3)N4C(=O)C5=C(C=CC(=C5)C)N(C4=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCC(CC3)N4C(=O)C5=C(C=CC(=C5)C)N(C4=O)C)OCC

InChI

InChI=1S/C27H30ClN5O4/c1-5-36-22-14-18-20(15-23(22)37-6-2)29-26(28)30-24(18)32-11-9-17(10-12-32)33-25(34)19-13-16(3)7-8-21(19)31(4)27(33)35/h7-8,13-15,17H,5-6,9-12H2,1-4H3