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

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[(5-ethanoyl-2,4-dimethoxy-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 2-[(5-acetyl-2,4-dimethoxy-phenyl)methylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2,4-dimethoxyphenyl)methylthio]-3-(3,5-dimethylphenyl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2,4-dimethoxyphenyl)methylsulfanyl]-3-(3,5-dimethylphenyl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2,4-dimethoxy-benzyl)thio]-3-(3,5-dimethylphenyl)quinazolin-4-one Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C(=C4)C(=O)C)OC)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C(=C4)C(=O)C)OC)OC)C

InChI

InChI=1S/C27H26N2O4S/c1-16-10-17(2)12-20(11-16)29-26(31)21-8-6-7-9-23(21)28-27(29)34-15-19-13-22(18(3)30)25(33-5)14-24(19)32-4/h6-14H,15H2,1-5H3