N-[3-chloranyl-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-phenyl]-N-methyl-ethanesulfonamide

Systemtic Name: N-[3-chloranyl-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-phenyl]-N-methyl-ethanesulfonamide Openeye Name: N-[3-chloro-4-[3-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanyl-phenyl]-N-methyl-ethanesulfonamide CAS Name: N-[3-chloro-4-[[3-(4-methoxy-4-oxanyl)phenyl]thio]phenyl]-N-methylethanesulfonamide IUPAC Name: N-[3-chloro-4-[3-(4-methoxyoxan-4-yl)phenyl]sulfanylphenyl]-N-methylethanesulfonamide Traditional Name: N-[3-chloro-4-[[3-(4-methoxytetrahydropyran-4-yl)phenyl]thio]phenyl]-N-methyl-ethanesulfonamide Formula: C21H26ClNO4S2 MolecularWeight: 456.01844

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(C)C1=CC(=C(C=C1)SC2=CC=CC(=C2)C3(CCOCC3)OC)Cl

Isomeric SMILES

CCS(=O)(=O)N(C)C1=CC(=C(C=C1)SC2=CC=CC(=C2)C3(CCOCC3)OC)Cl

InChI

InChI=1S/C21H26ClNO4S2/c1-4-29(24,25)23(2)17-8-9-20(19(22)15-17)28-18-7-5-6-16(14-18)21(26-3)10-12-27-13-11-21/h5-9,14-15H,4,10-13H2,1-3H3