4-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(2-chloro-6,7-dimethoxyquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C27H26ClN5O4 MolecularWeight: 519.97944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)OC

InChI

InChI=1S/C27H26ClN5O4/c1-35-23-16-21-22(17-24(23)36-2)30-26(28)31-25(21)32-12-14-33(15-13-32)27(34)29-18-8-10-20(11-9-18)37-19-6-4-3-5-7-19/h3-11,16-17H,12-15H2,1-2H3,(H,29,34)