N-(4-ethanoylphenyl)-2-(3,7,8-trimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-(3,7,8-trimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-acetylphenyl)-2-[(3,7,8-trimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(4-acetylphenyl)-2-[(3,7,8-trimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(4-acetylphenyl)-2-(3,7,8-trimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-acetylphenyl)-2-[(3,7,8-trimethyl-2-quinolyl)thio]propionamide Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)C)SC(C)C(=O)NC3=CC=C(C=C3)C(=O)C)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)C)SC(C)C(=O)NC3=CC=C(C=C3)C(=O)C)C

InChI

InChI=1S/C23H24N2O2S/c1-13-6-7-19-12-14(2)23(25-21(19)15(13)3)28-17(5)22(27)24-20-10-8-18(9-11-20)16(4)26/h6-12,17H,1-5H3,(H,24,27)