2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydro-1,3-thiazol-3-ium bromide

Systemtic Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydro-1,3-thiazol-3-ium bromide Openeye Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydrothiazol-3-ium bromide CAS Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydrothiazol-3-ium bromide IUPAC Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydro-1,3-thiazol-3-ium bromide Traditional Name: 2-methyl-3-[(2S)-2-methylbutyl]-2-thiazolin-3-ium bromide Formula: C9H18BrNS MolecularWeight: 252.21492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C[N+]1=C(SCC1)C.[Br-]

Isomeric SMILES

CC[C@H](C)C[N+]1=C(SCC1)C.[Br-]

InChI

InChI=1S/C9H18NS.BrH/c1-4-8(2)7-10-5-6-11-9(10)3;/h8H,4-7H2,1-3H3;1H/q+1;/p-1/t8-;/m0./s1