3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[(4-nitrobenzyl)thio]-3-veratryl-quinazolin-4-one Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C24H21N3O5S/c1-31-21-12-9-17(13-22(21)32-2)14-26-23(28)19-5-3-4-6-20(19)25-24(26)33-15-16-7-10-18(11-8-16)27(29)30/h3-13H,14-15H2,1-2H3