5-[(3,5,5-trimethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride

Systemtic Name: 5-[(3,5,5-trimethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride Openeye Name: 5-[(3,5,5-trimethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride CAS Name: 5-[[(3,5,5-trimethyl-1-oxohexyl)amino]methyl]-2-thiophenesulfonyl chloride IUPAC Name: 5-[(3,5,5-trimethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride Traditional Name: 5-[(3,5,5-trimethylhexanoylamino)methyl]thiophene-2-sulfonyl chloride Formula: C14H22ClNO3S2 MolecularWeight: 351.91238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22ClNO3S2/c1-10(8-14(2,3)4)7-12(17)16-9-11-5-6-13(20-11)21(15,18)19/h5-6,10H,7-9H2,1-4H3,(H,16,17)