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

Systemtic Name: pyridin-3-ylmethyl N-[3-[(3-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-7-yl]carbamate Openeye Name: 3-pyridylmethyl N-[3-[(3-fluorophenyl)methyl]-4-oxo-quinazolin-7-yl]carbamate CAS Name: N-[3-[(3-fluorophenyl)methyl]-4-oxo-7-quinazolinyl]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[3-[(3-fluorophenyl)methyl]-4-oxoquinazolin-7-yl]carbamate Traditional Name: N-[3-(3-fluorobenzyl)-4-keto-quinazolin-7-yl]carbamic acid 3-pyridylmethyl ester Formula: C22H17FN4O3 MolecularWeight: 404.393783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CN2C=NC3=C(C2=O)C=CC(=C3)NC(=O)OCC4=CN=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)F)CN2C=NC3=C(C2=O)C=CC(=C3)NC(=O)OCC4=CN=CC=C4

InChI

InChI=1S/C22H17FN4O3/c23-17-5-1-3-15(9-17)12-27-14-25-20-10-18(6-7-19(20)21(27)28)26-22(29)30-13-16-4-2-8-24-11-16/h1-11,14H,12-13H2,(H,26,29)