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

Systemtic Name: 4-[[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-[[2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]methyl]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[[2-[(3-nitrophenyl)methylthio]-4-oxo-3-quinazolinyl]methyl]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-[[2-[(3-nitrophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]methyl]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-[[4-keto-2-[(3-nitrobenzyl)thio]quinazolin-3-yl]methyl]-N-(tetrahydrofurfuryl)benzamide Formula: C28H26N4O5S MolecularWeight: 530.59484

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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)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H26N4O5S/c33-26(29-16-23-7-4-14-37-23)21-12-10-19(11-13-21)17-31-27(34)24-8-1-2-9-25(24)30-28(31)38-18-20-5-3-6-22(15-20)32(35)36/h1-3,5-6,8-13,15,23H,4,7,14,16-18H2,(H,29,33)