N-(3-ethanoylphenyl)-3-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-ethanoylphenyl)-3-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-acetylphenyl)-3-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(3-acetylphenyl)-3-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(3-acetylphenyl)-3-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-acetylphenyl)-3-[(4-methyl-2-quinolyl)thio]propionamide Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCCC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCCC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H20N2O2S/c1-14-12-21(23-19-9-4-3-8-18(14)19)26-11-10-20(25)22-17-7-5-6-16(13-17)15(2)24/h3-9,12-13H,10-11H2,1-2H3,(H,22,25)