4-fluoranyl-N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide hydrochloride

Systemtic Name: 4-fluoranyl-N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide hydrochloride Openeye Name: 4-fluoro-N-methyl-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide hydrochloride CAS Name: 4-fluoro-N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide hydrochloride IUPAC Name: 4-fluoro-N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide hydrochloride Traditional Name: 4-fluoro-N-methyl-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide hydrochloride Formula: C21H23ClFN3O3S MolecularWeight: 451.942023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)F.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C21H22FN3O3S.ClH/c1-16-13-19(25(2)29(26,27)21-5-3-17(22)4-6-21)15-20(14-16)28-12-11-24-18-7-9-23-10-8-18;/h3-10,13-15H,11-12H2,1-2H3,(H,23,24);1H