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

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C22H24N2O4S MolecularWeight: 412.50196

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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)N2CCOC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=O)N2CCOC

InChI

InChI=1S/C22H24N2O4S/c1-4-28-20-10-9-16(15(2)25)13-17(20)14-29-22-23-19-8-6-5-7-18(19)21(26)24(22)11-12-27-3/h5-10,13H,4,11-12,14H2,1-3H3