2-(phenylmethylsulfanyl)-N-quinolin-3-yl-propanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-quinolin-3-yl-propanamide Openeye Name: 2-benzylsulfanyl-N-(3-quinolyl)propanamide CAS Name: 2-(phenylmethylthio)-N-(3-quinolinyl)propanamide IUPAC Name: 2-benzylsulfanyl-N-quinolin-3-ylpropanamide Traditional Name: 2-(benzylthio)-N-(3-quinolyl)propionamide Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2N=C1)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2N=C1)SCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2OS/c1-14(23-13-15-7-3-2-4-8-15)19(22)21-17-11-16-9-5-6-10-18(16)20-12-17/h2-12,14H,13H2,1H3,(H,21,22)