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

Systemtic Name: N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Openeye Name: N-methyl-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide CAS Name: N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide IUPAC Name: N-methyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Traditional Name: N-methyl-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-17-14-19(24(2)28(25,26)21-6-4-3-5-7-21)16-20(15-17)27-13-12-23-18-8-10-22-11-9-18/h3-11,14-16H,12-13H2,1-2H3,(H,22,23)