pyridin-3-ylmethyl N-[3-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-4-oxidanylidene-quinazolin-7-yl]carbamate

Systemtic Name: pyridin-3-ylmethyl N-[3-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-4-oxidanylidene-quinazolin-7-yl]carbamate Openeye Name: 3-pyridylmethyl N-[3-[(4-chloro-3-fluoro-phenyl)methyl]-4-oxo-quinazolin-7-yl]carbamate CAS Name: N-[3-[(4-chloro-3-fluorophenyl)methyl]-4-oxo-7-quinazolinyl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[3-[(4-chloro-3-fluorophenyl)methyl]-4-oxoquinazolin-7-yl]carbamate Traditional Name: N-[3-(4-chloro-3-fluoro-benzyl)-4-keto-quinazolin-7-yl]carbamic acid 3-pyridylmethyl ester Formula: C22H16ClFN4O3 MolecularWeight: 438.838843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)COC(=O)NC2=CC3=C(C=C2)C(=O)N(C=N3)CC4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1=CC(=CN=C1)COC(=O)NC2=CC3=C(C=C2)C(=O)N(C=N3)CC4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C22H16ClFN4O3/c23-18-6-3-14(8-19(18)24)11-28-13-26-20-9-16(4-5-17(20)21(28)29)27-22(30)31-12-15-2-1-7-25-10-15/h1-10,13H,11-12H2,(H,27,30)