(2S)-1-(4-ethoxyphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one

Systemtic Name: (2S)-1-(4-ethoxyphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one Openeye Name: (2S)-1-(4-ethoxyphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one CAS Name: (2S)-1-(4-ethoxyphenyl)-2-[(2-methyl-4-quinazolinyl)thio]-1-propanone IUPAC Name: (2S)-1-(4-ethoxyphenyl)-2-(2-methylquinazolin-4-yl)sulfanylpropan-1-one Traditional Name: (2S)-2-[(2-methylquinazolin-4-yl)thio]-1-p-phenetyl-propan-1-one Formula: C20H20N2O2S MolecularWeight: 352.45

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)SC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C20H20N2O2S/c1-4-24-16-11-9-15(10-12-16)19(23)13(2)25-20-17-7-5-6-8-18(17)21-14(3)22-20/h5-13H,4H2,1-3H3/t13-/m0/s1