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

Systemtic Name: N-(4-ethanoylphenyl)-3-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-acetylphenyl)-3-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(4-acetylphenyl)-3-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(4-acetylphenyl)-3-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-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=C(C=C3)C(=O)C

Isomeric SMILES

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

InChI

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