N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-8-ethoxy-quinoline-5-sulfonamide

Systemtic Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-8-ethoxy-quinoline-5-sulfonamide Openeye Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-8-ethoxy-quinoline-5-sulfonamide CAS Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-8-ethoxy-5-quinolinesulfonamide IUPAC Name: N-[2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]phenyl]-8-ethoxyquinoline-5-sulfonamide Traditional Name: N-[2-[2-(4-chlorophenyl)sulfonylethylthio]phenyl]-8-ethoxy-quinoline-5-sulfonamide Formula: C25H23ClN2O5S3 MolecularWeight: 563.10852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)NC3=CC=CC=C3SCCS(=O)(=O)C4=CC=C(C=C4)Cl)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)NC3=CC=CC=C3SCCS(=O)(=O)C4=CC=C(C=C4)Cl)C=CC=N2

InChI

InChI=1S/C25H23ClN2O5S3/c1-2-33-22-13-14-24(20-6-5-15-27-25(20)22)36(31,32)28-21-7-3-4-8-23(21)34-16-17-35(29,30)19-11-9-18(26)10-12-19/h3-15,28H,2,16-17H2,1H3