2-[(3-ethanoyl-2,4,6-trimethyl-phenyl)methylsulfanyl]-3-(5-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[(3-ethanoyl-2,4,6-trimethyl-phenyl)methylsulfanyl]-3-(5-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(3-acetyl-2,4,6-trimethyl-phenyl)methylsulfanyl]-3-(5-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[(3-acetyl-2,4,6-trimethylphenyl)methylthio]-3-(5-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(3-acetyl-2,4,6-trimethylphenyl)methylsulfanyl]-3-(5-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[(3-acetyl-2,4,6-trimethyl-benzyl)thio]-3-(5-methyl-2-pyridyl)quinazolin-4-one Formula: C26H25N3O2S MolecularWeight: 443.5606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C(=C4C)C(=O)C)C)C

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C(=C4C)C(=O)C)C)C

InChI

InChI=1S/C26H25N3O2S/c1-15-10-11-23(27-13-15)29-25(31)20-8-6-7-9-22(20)28-26(29)32-14-21-16(2)12-17(3)24(18(21)4)19(5)30/h6-13H,14H2,1-5H3