6-[2-chloranyl-4-(2-oxidanyl-4-pyridin-3-yl-butoxy)phenyl]pyridine-3-sulfonamide

Systemtic Name: 6-[2-chloranyl-4-(2-oxidanyl-4-pyridin-3-yl-butoxy)phenyl]pyridine-3-sulfonamide Openeye Name: 6-[2-chloro-4-[2-hydroxy-4-(3-pyridyl)butoxy]phenyl]pyridine-3-sulfonamide CAS Name: 6-[2-chloro-4-[2-hydroxy-4-(3-pyridinyl)butoxy]phenyl]-3-pyridinesulfonamide IUPAC Name: 6-[2-chloro-4-(2-hydroxy-4-pyridin-3-ylbutoxy)phenyl]pyridine-3-sulfonamide Traditional Name: 6-[2-chloro-4-[2-hydroxy-4-(3-pyridyl)butoxy]phenyl]pyridine-3-sulfonamide Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC(COC2=CC(=C(C=C2)C3=NC=C(C=C3)S(=O)(=O)N)Cl)O

Isomeric SMILES

C1=CC(=CN=C1)CCC(COC2=CC(=C(C=C2)C3=NC=C(C=C3)S(=O)(=O)N)Cl)O

InChI

InChI=1S/C20H20ClN3O4S/c21-19-10-16(28-13-15(25)4-3-14-2-1-9-23-11-14)5-7-18(19)20-8-6-17(12-24-20)29(22,26)27/h1-2,5-12,15,25H,3-4,13H2,(H2,22,26,27)