2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-3-(3-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-3-(3-methoxyphenyl)quinazolin-4-one Openeye Name: 2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-3-(3-methoxyphenyl)quinazolin-4-one CAS Name: 2-[(2-methoxy-5-nitrophenyl)methylthio]-3-(3-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(2-methoxy-5-nitrophenyl)methylsulfanyl]-3-(3-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[(2-methoxy-5-nitro-benzyl)thio]-3-(3-methoxyphenyl)quinazolin-4-one Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H19N3O5S/c1-30-18-7-5-6-16(13-18)25-22(27)19-8-3-4-9-20(19)24-23(25)32-14-15-12-17(26(28)29)10-11-21(15)31-2/h3-13H,14H2,1-2H3