N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-(4-pyrrolidinosulfonylphenyl)-2-(8-quinolylthio)acetamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H21N3O3S2/c25-20(15-28-19-7-3-5-16-6-4-12-22-21(16)19)23-17-8-10-18(11-9-17)29(26,27)24-13-1-2-14-24/h3-12H,1-2,13-15H2,(H,23,25)