N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-(2-quinolylthio)acetamide Formula: C21H20ClN3O3S2 MolecularWeight: 461.9848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H20ClN3O3S2/c22-17-9-8-16(30(27,28)25-11-3-4-12-25)13-19(17)23-20(26)14-29-21-10-7-15-5-1-2-6-18(15)24-21/h1-2,5-10,13H,3-4,11-12,14H2,(H,23,26)