4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[[2-[(4-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]methyl]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-[[2-[(4-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-[[2-[(4-fluorobenzyl)thio]-4-keto-quinazolin-3-yl]methyl]-N-(tetrahydrofurfuryl)benzamide Formula: C28H26FN3O3S MolecularWeight: 503.587743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC5=CC=C(C=C5)F

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC5=CC=C(C=C5)F

InChI

InChI=1S/C28H26FN3O3S/c29-22-13-9-20(10-14-22)18-36-28-31-25-6-2-1-5-24(25)27(34)32(28)17-19-7-11-21(12-8-19)26(33)30-16-23-4-3-15-35-23/h1-2,5-14,23H,3-4,15-18H2,(H,30,33)