5-[3-(ethylaminomethyl)-4-oxidanyl-phenyl]sulfonylthiophene-2-sulfonamide

Systemtic Name: 5-[3-(ethylaminomethyl)-4-oxidanyl-phenyl]sulfonylthiophene-2-sulfonamide Openeye Name: 5-[3-(ethylaminomethyl)-4-hydroxy-phenyl]sulfonylthiophene-2-sulfonamide CAS Name: 5-[3-(ethylaminomethyl)-4-hydroxyphenyl]sulfonyl-2-thiophenesulfonamide IUPAC Name: 5-[3-(ethylaminomethyl)-4-hydroxyphenyl]sulfonylthiophene-2-sulfonamide Traditional Name: 5-[3-(ethylaminomethyl)-4-hydroxy-phenyl]sulfonylthiophene-2-sulfonamide Formula: C13H16N2O5S3 MolecularWeight: 376.47154

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(C=CC(=C1)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)N)O

Isomeric SMILES

CCNCC1=C(C=CC(=C1)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)N)O

InChI

InChI=1S/C13H16N2O5S3/c1-2-15-8-9-7-10(3-4-11(9)16)22(17,18)12-5-6-13(21-12)23(14,19)20/h3-7,15-16H,2,8H2,1H3,(H2,14,19,20)