5-[3-(methylsulfonylamino)prop-1-ynyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(methylsulfonylamino)prop-1-ynyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-(methanesulfonamido)prop-1-ynyl]thiophene-2-carboxylic acid CAS Name: 5-[3-(methanesulfonamido)prop-1-ynyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(methanesulfonamido)prop-1-ynyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-(methanesulfonamido)prop-1-ynyl]-2-thenoic acid Formula: C9H9NO4S2 MolecularWeight: 259.30206

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC#CC1=CC=C(S1)C(=O)O

Isomeric SMILES

CS(=O)(=O)NCC#CC1=CC=C(S1)C(=O)O

InChI

InChI=1S/C9H9NO4S2/c1-16(13,14)10-6-2-3-7-4-5-8(15-7)9(11)12/h4-5,10H,6H2,1H3,(H,11,12)