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

Systemtic Name: (2S)-1-(4-ethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one Openeye Name: (2S)-1-(4-ethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one CAS Name: (2S)-1-(4-ethylphenyl)-2-[(2-methyl-4-quinazolinyl)thio]-1-propanone IUPAC Name: (2S)-1-(4-ethylphenyl)-2-(2-methylquinazolin-4-yl)sulfanylpropan-1-one Traditional Name: (2S)-1-(4-ethylphenyl)-2-[(2-methylquinazolin-4-yl)thio]propan-1-one Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)SC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C20H20N2OS/c1-4-15-9-11-16(12-10-15)19(23)13(2)24-20-17-7-5-6-8-18(17)21-14(3)22-20/h5-13H,4H2,1-3H3/t13-/m0/s1