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

Systemtic Name: 4-[[2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-[[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[[2-[(3-chlorophenyl)methylthio]-4-oxo-3-quinazolinyl]methyl]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-[[2-[(3-chlorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-[[2-[(3-chlorobenzyl)thio]-4-keto-quinazolin-3-yl]methyl]-N-(tetrahydrofurfuryl)benzamide Formula: C28H26ClN3O3S MolecularWeight: 520.04234

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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(=CC=C5)Cl

Isomeric SMILES

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

InChI

InChI=1S/C28H26ClN3O3S/c29-22-6-3-5-20(15-22)18-36-28-31-25-9-2-1-8-24(25)27(34)32(28)17-19-10-12-21(13-11-19)26(33)30-16-23-7-4-14-35-23/h1-3,5-6,8-13,15,23H,4,7,14,16-18H2,(H,30,33)