[(2S)-2-ethylhexyl]-[(2-methyl-1,3-thiazol-4-yl)methyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[(2-methyl-1,3-thiazol-4-yl)methyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(2-methylthiazol-4-yl)methyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[(2-methyl-4-thiazolyl)methyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[(2-methyl-1,3-thiazol-4-yl)methyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[(2-methylthiazol-4-yl)methyl]ammonium Formula: C13H25N2S+ MolecularWeight: 241.416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]CC1=CSC(=N1)C

Isomeric SMILES

CCCC[C@H](CC)C[NH2+]CC1=CSC(=N1)C

InChI

InChI=1S/C13H24N2S/c1-4-6-7-12(5-2)8-14-9-13-10-16-11(3)15-13/h10,12,14H,4-9H2,1-3H3/p+1/t12-/m0/s1