N-tert-butyl-4-[7-chloranyl-2-(4-fluorophenyl)quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[7-chloranyl-2-(4-fluorophenyl)quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[7-chloro-2-(4-fluorophenyl)-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[7-chloro-2-(4-fluorophenyl)quinazolin-4-yl]piperazine-1-carboxamide Formula: C23H25ClFN5O MolecularWeight: 441.928903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=CC(=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)NC(=O)N1CCN(CC1)C2=NC(=NC3=C2C=CC(=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H25ClFN5O/c1-23(2,3)28-22(31)30-12-10-29(11-13-30)21-18-9-6-16(24)14-19(18)26-20(27-21)15-4-7-17(25)8-5-15/h4-9,14H,10-13H2,1-3H3,(H,28,31)