2-[(5-ethanoyl-2,4-dimethoxy-phenyl)methylsulfanyl]-3-(4-ethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(5-ethanoyl-2,4-dimethoxy-phenyl)methylsulfanyl]-3-(4-ethoxyphenyl)quinazolin-4-one Openeye Name: 2-[(5-acetyl-2,4-dimethoxy-phenyl)methylsulfanyl]-3-(4-ethoxyphenyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2,4-dimethoxyphenyl)methylthio]-3-(4-ethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2,4-dimethoxyphenyl)methylsulfanyl]-3-(4-ethoxyphenyl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2,4-dimethoxy-benzyl)thio]-3-p-phenetyl-quinazolin-4-one Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C(=C4)C(=O)C)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C(=C4)C(=O)C)OC)OC

InChI

InChI=1S/C27H26N2O5S/c1-5-34-20-12-10-19(11-13-20)29-26(31)21-8-6-7-9-23(21)28-27(29)35-16-18-14-22(17(2)30)25(33-4)15-24(18)32-3/h6-15H,5,16H2,1-4H3