N-(4-methoxyphenyl)-2-quinolin-2-ylsulfanyl-butanamide

Systemtic Name: N-(4-methoxyphenyl)-2-quinolin-2-ylsulfanyl-butanamide Openeye Name: N-(4-methoxyphenyl)-2-(2-quinolylsulfanyl)butanamide CAS Name: N-(4-methoxyphenyl)-2-(2-quinolinylthio)butanamide IUPAC Name: N-(4-methoxyphenyl)-2-quinolin-2-ylsulfanylbutanamide Traditional Name: N-(4-methoxyphenyl)-2-(2-quinolylthio)butyramide Formula: C20H20N2O2S MolecularWeight: 352.45

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H20N2O2S/c1-3-18(20(23)21-15-9-11-16(24-2)12-10-15)25-19-13-8-14-6-4-5-7-17(14)22-19/h4-13,18H,3H2,1-2H3,(H,21,23)