4-(5-chloranylquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(5-chloranylquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(5-chloroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(5-chloro-4-quinazolinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(5-chloroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(5-chloroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C25H22ClN5O2 MolecularWeight: 459.92748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C(=CC=C3)Cl)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C(=CC=C3)Cl)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H22ClN5O2/c26-21-7-4-8-22-23(21)24(28-17-27-22)30-13-15-31(16-14-30)25(32)29-18-9-11-20(12-10-18)33-19-5-2-1-3-6-19/h1-12,17H,13-16H2,(H,29,32)