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

Systemtic Name: 5-[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]sulfonylthiophene-2-sulfonamide hydrochloride Openeye Name: 5-[3-(dimethylaminomethyl)-4-hydroxy-phenyl]sulfonylthiophene-2-sulfonamide hydrochloride CAS Name: 5-[3-(dimethylaminomethyl)-4-hydroxyphenyl]sulfonyl-2-thiophenesulfonamide hydrochloride IUPAC Name: 5-[3-(dimethylaminomethyl)-4-hydroxyphenyl]sulfonylthiophene-2-sulfonamide hydrochloride Traditional Name: 5-[3-(dimethylaminomethyl)-4-hydroxy-phenyl]sulfonylthiophene-2-sulfonamide hydrochloride Formula: C13H17ClN2O5S3 MolecularWeight: 412.93248

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)N)O.Cl

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)S(=O)(=O)C2=CC=C(S2)S(=O)(=O)N)O.Cl

InChI

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