5-[(2-ethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride

Systemtic Name: 5-[(2-ethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride Openeye Name: 5-[(2-ethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride CAS Name: 5-[[(2-ethyl-1-oxohexyl)amino]methyl]-2-thiophenesulfonyl chloride IUPAC Name: 5-[(2-ethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride Traditional Name: 5-[(2-ethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride Formula: C13H20ClNO3S2 MolecularWeight: 337.8858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NCC1=CC=C(S1)S(=O)(=O)Cl

Isomeric SMILES

CCCCC(CC)C(=O)NCC1=CC=C(S1)S(=O)(=O)Cl

InChI

InChI=1S/C13H20ClNO3S2/c1-3-5-6-10(4-2)13(16)15-9-11-7-8-12(19-11)20(14,17)18/h7-8,10H,3-6,9H2,1-2H3,(H,15,16)