6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-[(3-nitrophenyl)methylthio]-4-quinazolinone IUPAC Name: 6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-[(3-nitrophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[(3-nitrobenzyl)thio]-3-p-anisyl-quinazolin-4-one Formula: C25H23N3O6S MolecularWeight: 493.53162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O6S/c1-32-19-9-7-16(8-10-19)14-27-24(29)20-12-22(33-2)23(34-3)13-21(20)26-25(27)35-15-17-5-4-6-18(11-17)28(30)31/h4-13H,14-15H2,1-3H3