2-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[2-(2-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-benzyl-2-[(5-methyl-2-o-phenetyl-oxazol-4-yl)methylthio]quinazolin-4-one Formula: C28H25N3O3S MolecularWeight: 483.5814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=C(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=C(O2)C)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C28H25N3O3S/c1-3-33-25-16-10-8-14-22(25)26-29-24(19(2)34-26)18-35-28-30-23-15-9-7-13-21(23)27(32)31(28)17-20-11-5-4-6-12-20/h4-16H,3,17-18H2,1-2H3