5-bromanyl-N-[1-oxidanyl-3-(phenylmethylsulfanyl)propan-2-yl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[1-oxidanyl-3-(phenylmethylsulfanyl)propan-2-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(benzylsulfanylmethyl)-2-hydroxy-ethyl]-5-bromo-thiophene-2-sulfonamide CAS Name: 5-bromo-N-[1-hydroxy-3-(phenylmethylthio)propan-2-yl]-2-thiophenesulfonamide IUPAC Name: N-(1-benzylsulfanyl-3-hydroxypropan-2-yl)-5-bromothiophene-2-sulfonamide Traditional Name: N-[1-[(benzylthio)methyl]-2-hydroxy-ethyl]-5-bromo-thiophene-2-sulfonamide Formula: C14H16BrNO3S3 MolecularWeight: 422.38074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(CO)NS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

C1=CC=C(C=C1)CSCC(CO)NS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H16BrNO3S3/c15-13-6-7-14(21-13)22(18,19)16-12(8-17)10-20-9-11-4-2-1-3-5-11/h1-7,12,16-17H,8-10H2