N-(2-azanylethyl)-1-[2-oxidanyl-3-(4-oxidanylphenoxy)propyl]-N-phenyl-3H-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-(2-azanylethyl)-1-[2-oxidanyl-3-(4-oxidanylphenoxy)propyl]-N-phenyl-3H-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(2-aminoethyl)-1-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]-N-phenyl-3H-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-(2-aminoethyl)-1-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]-N-phenyl-3H-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(2-aminoethyl)-1-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]-N-phenyl-3H-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(2-aminoethyl)-1-[2-hydroxy-3-(4-hydroxyphenoxy)propyl]-N-phenyl-3H-piazthiole-4-sulfonamide Formula: C23H26N4O5S2 MolecularWeight: 502.60634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCN)S(=O)(=O)C2=CC=CC3=C2NSN3CC(COC4=CC=C(C=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)N(CCN)S(=O)(=O)C2=CC=CC3=C2NSN3CC(COC4=CC=C(C=C4)O)O

InChI

InChI=1S/C23H26N4O5S2/c24-13-14-27(17-5-2-1-3-6-17)34(30,31)22-8-4-7-21-23(22)25-33-26(21)15-19(29)16-32-20-11-9-18(28)10-12-20/h1-12,19,25,28-29H,13-16,24H2