[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(2-chloranyl-4-phenylmethoxy-phenyl)methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(2-chloranyl-4-phenylmethoxy-phenyl)methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(4-benzyloxy-2-chloro-phenyl)methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-(2-chloro-4-phenylmethoxyphenyl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2-chloro-4-phenylmethoxyphenyl)methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-(4-benzoxy-2-chloro-phenyl)methanone Formula: C28H28ClN5O4 MolecularWeight: 534.00602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)OCC5=CC=CC=C5)Cl)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)OCC5=CC=CC=C5)Cl)N)OC

InChI

InChI=1S/C28H28ClN5O4/c1-36-24-15-21-23(16-25(24)37-2)31-28(32-26(21)30)34-12-10-33(11-13-34)27(35)20-9-8-19(14-22(20)29)38-17-18-6-4-3-5-7-18/h3-9,14-16H,10-13,17H2,1-2H3,(H2,30,31,32)