5-[4-(2-oxidanyl-4-pyridin-3-yl-butyl)sulfanylphenyl]thiophene-2-sulfonamide

Systemtic Name: 5-[4-(2-oxidanyl-4-pyridin-3-yl-butyl)sulfanylphenyl]thiophene-2-sulfonamide Openeye Name: 5-[4-[2-hydroxy-4-(3-pyridyl)butyl]sulfanylphenyl]thiophene-2-sulfonamide CAS Name: 5-[4-[[2-hydroxy-4-(3-pyridinyl)butyl]thio]phenyl]-2-thiophenesulfonamide IUPAC Name: 5-[4-(2-hydroxy-4-pyridin-3-ylbutyl)sulfanylphenyl]thiophene-2-sulfonamide Traditional Name: 5-[4-[[2-hydroxy-4-(3-pyridyl)butyl]thio]phenyl]thiophene-2-sulfonamide Formula: C19H20N2O3S3 MolecularWeight: 420.5687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC(CSC2=CC=C(C=C2)C3=CC=C(S3)S(=O)(=O)N)O

Isomeric SMILES

C1=CC(=CN=C1)CCC(CSC2=CC=C(C=C2)C3=CC=C(S3)S(=O)(=O)N)O

InChI

InChI=1S/C19H20N2O3S3/c20-27(23,24)19-10-9-18(26-19)15-4-7-17(8-5-15)25-13-16(22)6-3-14-2-1-11-21-12-14/h1-2,4-5,7-12,16,22H,3,6,13H2,(H2,20,23,24)