N-[(1R,2R)-2-(4-methoxyphenyl)sulfanylcyclohexyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-2-(4-methoxyphenyl)sulfanylcyclohexyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-(4-methoxyphenyl)sulfanylcyclohexyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R)-2-[(4-methoxyphenyl)thio]cyclohexyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-(4-methoxyphenyl)sulfanylcyclohexyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-[(4-methoxyphenyl)thio]cyclohexyl]-4-methyl-benzenesulfonamide Formula: C20H25NO3S2 MolecularWeight: 391.5474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2SC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]2CCCC[C@H]2SC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25NO3S2/c1-15-7-13-18(14-8-15)26(22,23)21-19-5-3-4-6-20(19)25-17-11-9-16(24-2)10-12-17/h7-14,19-21H,3-6H2,1-2H3/t19-,20-/m1/s1