2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-3-(1-methoxypropan-2-yl)-4-quinazolinone IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one Formula: C23H26N2O4S MolecularWeight: 426.52854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O4S/c1-5-29-21-11-10-17(16(3)26)12-18(21)14-30-23-24-20-9-7-6-8-19(20)22(27)25(23)15(2)13-28-4/h6-12,15H,5,13-14H2,1-4H3