4-phenylsulfanyl-N-quinolin-5-yl-butanamide

Systemtic Name: 4-phenylsulfanyl-N-quinolin-5-yl-butanamide Openeye Name: 4-phenylsulfanyl-N-(5-quinolyl)butanamide CAS Name: 4-(phenylthio)-N-(5-quinolinyl)butanamide IUPAC Name: 4-phenylsulfanyl-N-quinolin-5-ylbutanamide Traditional Name: 4-(phenylthio)-N-(5-quinolyl)butyramide Formula: C19H18N2OS MolecularWeight: 322.42402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C19H18N2OS/c22-19(12-6-14-23-15-7-2-1-3-8-15)21-18-11-4-10-17-16(18)9-5-13-20-17/h1-5,7-11,13H,6,12,14H2,(H,21,22)