2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-(3-methylphenyl)quinazolin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-(3-methylphenyl)quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-3-(m-tolyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-3-(3-methylphenyl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-3-(3-methylphenyl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-(m-tolyl)quinazolin-4-one Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC(=C4)C

InChI

InChI=1S/C26H24N2O3S/c1-4-31-24-13-12-19(18(3)29)15-20(24)16-32-26-27-23-11-6-5-10-22(23)25(30)28(26)21-9-7-8-17(2)14-21/h5-15H,4,16H2,1-3H3