1-[3-[(2R)-3-(2-methylquinazolin-4-yl)sulfanyl-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[3-[(2R)-3-(2-methylquinazolin-4-yl)sulfanyl-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[3-[(2R)-2-hydroxy-3-(2-methylquinazolin-4-yl)sulfanyl-propoxy]phenyl]ethanone CAS Name: 1-[3-[(2R)-2-hydroxy-3-[(2-methyl-4-quinazolinyl)thio]propoxy]phenyl]ethanone IUPAC Name: 1-[3-[(2R)-2-hydroxy-3-(2-methylquinazolin-4-yl)sulfanylpropoxy]phenyl]ethanone Traditional Name: 1-[3-[(2R)-2-hydroxy-3-[(2-methylquinazolin-4-yl)thio]propoxy]phenyl]ethanone Formula: C20H20N2O3S MolecularWeight: 368.4494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(COC3=CC=CC(=C3)C(=O)C)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SC[C@@H](COC3=CC=CC(=C3)C(=O)C)O

InChI

InChI=1S/C20H20N2O3S/c1-13(23)15-6-5-7-17(10-15)25-11-16(24)12-26-20-18-8-3-4-9-19(18)21-14(2)22-20/h3-10,16,24H,11-12H2,1-2H3/t16-/m1/s1