2,2-dimethyl-N-[[5-(2-quinolin-2-ylsulfanylethanoyl)thiophen-2-yl]methyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[5-(2-quinolin-2-ylsulfanylethanoyl)thiophen-2-yl]methyl]propanamide Openeye Name: 2,2-dimethyl-N-[[5-[2-(2-quinolylsulfanyl)acetyl]-2-thienyl]methyl]propanamide CAS Name: 2,2-dimethyl-N-[[5-[1-oxo-2-(2-quinolinylthio)ethyl]-2-thiophenyl]methyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[5-(2-quinolin-2-ylsulfanylacetyl)thiophen-2-yl]methyl]propanamide Traditional Name: 2,2-dimethyl-N-[[5-[2-(2-quinolylthio)acetyl]-2-thienyl]methyl]propionamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCC1=CC=C(S1)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)C(=O)NCC1=CC=C(S1)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H22N2O2S2/c1-21(2,3)20(25)22-12-15-9-10-18(27-15)17(24)13-26-19-11-8-14-6-4-5-7-16(14)23-19/h4-11H,12-13H2,1-3H3,(H,22,25)