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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C23H26N2OS/c1-3-4-7-18-10-12-19(13-11-18)24-22(26)14-15-27-23-16-17(2)20-8-5-6-9-21(20)25-23/h5-6,8-13,16H,3-4,7,14-15H2,1-2H3,(H,24,26)