N-[4-chloranyl-2-(3-chloranylpropoxy)phenyl]-N-(pyridin-4-ylmethyl)hexane-1-sulfonamide

Systemtic Name: N-[4-chloranyl-2-(3-chloranylpropoxy)phenyl]-N-(pyridin-4-ylmethyl)hexane-1-sulfonamide Openeye Name: N-[4-chloro-2-(3-chloropropoxy)phenyl]-N-(4-pyridylmethyl)hexane-1-sulfonamide CAS Name: N-[4-chloro-2-(3-chloropropoxy)phenyl]-N-(pyridin-4-ylmethyl)-1-hexanesulfonamide IUPAC Name: N-[4-chloro-2-(3-chloropropoxy)phenyl]-N-(pyridin-4-ylmethyl)hexane-1-sulfonamide Traditional Name: N-[4-chloro-2-(3-chloropropoxy)phenyl]-N-(4-pyridylmethyl)hexane-1-sulfonamide Formula: C21H28Cl2N2O3S MolecularWeight: 459.42962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)N(CC1=CC=NC=C1)C2=C(C=C(C=C2)Cl)OCCCCl

Isomeric SMILES

CCCCCCS(=O)(=O)N(CC1=CC=NC=C1)C2=C(C=C(C=C2)Cl)OCCCCl

InChI

InChI=1S/C21H28Cl2N2O3S/c1-2-3-4-5-15-29(26,27)25(17-18-9-12-24-13-10-18)20-8-7-19(23)16-21(20)28-14-6-11-22/h7-10,12-13,16H,2-6,11,14-15,17H2,1H3