N-(2,6-diethylphenyl)-3-(4-methylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2,6-diethylphenyl)-3-(4-methylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2,6-diethylphenyl)-3-[(4-methyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(2,6-diethylphenyl)-3-[(4-methyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(2,6-diethylphenyl)-3-(4-methylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(2,6-diethylphenyl)-3-[(4-methyl-2-quinolyl)thio]propionamide Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C23H26N2OS/c1-4-17-9-8-10-18(5-2)23(17)25-21(26)13-14-27-22-15-16(3)19-11-6-7-12-20(19)24-22/h6-12,15H,4-5,13-14H2,1-3H3,(H,25,26)