N-[[7-chloranyl-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: N-[[7-chloranyl-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]cyclohex-3-ene-1-carboxamide Openeye Name: N-[[7-chloro-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]cyclohex-3-ene-1-carboxamide CAS Name: N-[[7-chloro-4-[(4-fluorophenyl)methylamino]-2-quinazolinyl]methyl]-1-cyclohex-3-enecarboxamide IUPAC Name: N-[[7-chloro-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]cyclohex-3-ene-1-carboxamide Traditional Name: N-[[7-chloro-4-[(4-fluorobenzyl)amino]quinazolin-2-yl]methyl]cyclohex-3-ene-1-carboxamide Formula: C23H22ClFN4O MolecularWeight: 424.898383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NCC2=NC3=C(C=CC(=C3)Cl)C(=N2)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CC=C1)C(=O)NCC2=NC3=C(C=CC(=C3)Cl)C(=N2)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H22ClFN4O/c24-17-8-11-19-20(12-17)28-21(14-27-23(30)16-4-2-1-3-5-16)29-22(19)26-13-15-6-9-18(25)10-7-15/h1-2,6-12,16H,3-5,13-14H2,(H,27,30)(H,26,28,29)