N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-(2-quinolylthio)acetamide Formula: C21H20ClN3O4S2 MolecularWeight: 477.9842

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C21H20ClN3O4S2/c22-17-7-6-16(13-19(17)31(27,28)25-9-11-29-12-10-25)23-20(26)14-30-21-8-5-15-3-1-2-4-18(15)24-21/h1-8,13H,9-12,14H2,(H,23,26)