2-tert-butyl-3-(2,4-dimethoxyphenyl)-N-[3-(methylsulfonylaminomethyl)phenyl]octanamide

Systemtic Name: 2-tert-butyl-3-(2,4-dimethoxyphenyl)-N-[3-(methylsulfonylaminomethyl)phenyl]octanamide Openeye Name: 2-tert-butyl-3-(2,4-dimethoxyphenyl)-N-[3-(methanesulfonamidomethyl)phenyl]octanamide CAS Name: 2-tert-butyl-3-(2,4-dimethoxyphenyl)-N-[3-(methanesulfonamidomethyl)phenyl]octanamide IUPAC Name: 2-tert-butyl-3-(2,4-dimethoxyphenyl)-N-[3-(methanesulfonamidomethyl)phenyl]octanamide Traditional Name: 2-tert-butyl-3-(2,4-dimethoxyphenyl)-N-[3-(methanesulfonamidomethyl)phenyl]caprylamide Formula: C28H42N2O5S MolecularWeight: 518.70848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C=C(C=C1)OC)OC)C(C(=O)NC2=CC=CC(=C2)CNS(=O)(=O)C)C(C)(C)C

Isomeric SMILES

CCCCCC(C1=C(C=C(C=C1)OC)OC)C(C(=O)NC2=CC=CC(=C2)CNS(=O)(=O)C)C(C)(C)C

InChI

InChI=1S/C28H42N2O5S/c1-8-9-10-14-24(23-16-15-22(34-5)18-25(23)35-6)26(28(2,3)4)27(31)30-21-13-11-12-20(17-21)19-29-36(7,32)33/h11-13,15-18,24,26,29H,8-10,14,19H2,1-7H3,(H,30,31)