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

Systemtic Name: 4-[4-(diethylaminomethyl)-3-oxidanyl-phenyl]sulfonylthiophene-2-sulfonamide hydrochloride Openeye Name: 4-[4-(diethylaminomethyl)-3-hydroxy-phenyl]sulfonylthiophene-2-sulfonamide hydrochloride CAS Name: 4-[4-(diethylaminomethyl)-3-hydroxyphenyl]sulfonyl-2-thiophenesulfonamide hydrochloride IUPAC Name: 4-[4-(diethylaminomethyl)-3-hydroxyphenyl]sulfonylthiophene-2-sulfonamide hydrochloride Traditional Name: 4-[4-(diethylaminomethyl)-3-hydroxy-phenyl]sulfonylthiophene-2-sulfonamide hydrochloride Formula: C15H21ClN2O5S3 MolecularWeight: 440.98564

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=C(C=C1)S(=O)(=O)C2=CSC(=C2)S(=O)(=O)N)O.Cl

Isomeric SMILES

CCN(CC)CC1=C(C=C(C=C1)S(=O)(=O)C2=CSC(=C2)S(=O)(=O)N)O.Cl

InChI

InChI=1S/C15H20N2O5S3.ClH/c1-3-17(4-2)9-11-5-6-12(7-14(11)18)24(19,20)13-8-15(23-10-13)25(16,21)22;/h5-8,10,18H,3-4,9H2,1-2H3,(H2,16,21,22);1H