N-(4-acetamidophenyl)-2-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(4-acetamidophenyl)-2-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[(4-methyl-2-quinolyl)thio]propionamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H21N3O2S/c1-13-12-20(24-19-7-5-4-6-18(13)19)27-14(2)21(26)23-17-10-8-16(9-11-17)22-15(3)25/h4-12,14H,1-3H3,(H,22,25)(H,23,26)