tert-butyl N-[(1S,2S)-2-methyl-1-(4-methyl-5H-1,3-thiazol-1-ium-2-yl)butyl]carbamate bromide

Systemtic Name: tert-butyl N-[(1S,2S)-2-methyl-1-(4-methyl-5H-1,3-thiazol-1-ium-2-yl)butyl]carbamate bromide Openeye Name: tert-butyl N-[(1S,2S)-2-methyl-1-(4-methyl-5H-thiazol-1-ium-2-yl)butyl]carbamate bromide CAS Name: N-[(1S,2S)-2-methyl-1-(4-methyl-5H-thiazol-1-ium-2-yl)butyl]carbamic acid tert-butyl ester bromide IUPAC Name: tert-butyl N-[(1S,2S)-2-methyl-1-(4-methyl-5H-1,3-thiazol-1-ium-2-yl)butyl]carbamate bromide Traditional Name: N-[(1S,2S)-2-methyl-1-(4-methyl-5H-thiazol-1-ium-2-yl)butyl]carbamic acid tert-butyl ester bromide Formula: C14H25BrN2O2S MolecularWeight: 365.3295

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=[S+]CC(=N1)C)NC(=O)OC(C)(C)C.[Br-]

Isomeric SMILES

CC[C@H](C)[C@@H](C1=[S+]CC(=N1)C)NC(=O)OC(C)(C)C.[Br-]

InChI

InChI=1S/C14H24N2O2S.BrH/c1-7-9(2)11(12-15-10(3)8-19-12)16-13(17)18-14(4,5)6;/h9,11H,7-8H2,1-6H3;1H/t9-,11-;/m0./s1