2-(3,8-dimethylquinolin-2-yl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: 2-(3,8-dimethylquinolin-2-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[(3,8-dimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: 2-[(3,8-dimethyl-2-quinolinyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-(3,8-dimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-benzyl-2-[(3,8-dimethyl-2-quinolyl)thio]propionamide Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)SC(C)C(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)SC(C)C(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2OS/c1-14-8-7-11-18-12-15(2)21(23-19(14)18)25-16(3)20(24)22-13-17-9-5-4-6-10-17/h4-12,16H,13H2,1-3H3,(H,22,24)