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

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-3-isopropyl-quinazolin-4-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-isopropyl-quinazolin-4-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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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)N2C(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=CC=CC=C3C(=O)N2C(C)C

InChI

InChI=1S/C22H24N2O3S/c1-5-27-20-11-10-16(15(4)25)12-17(20)13-28-22-23-19-9-7-6-8-18(19)21(26)24(22)14(2)3/h6-12,14H,5,13H2,1-4H3