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

Systemtic Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydro-1,3-thiazol-3-ium Openeye Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydrothiazol-3-ium CAS Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydrothiazol-3-ium IUPAC Name: 2-methyl-3-[(2S)-2-methylbutyl]-4,5-dihydro-1,3-thiazol-3-ium Traditional Name: 2-methyl-3-[(2S)-2-methylbutyl]-2-thiazolin-3-ium Formula: C9H18NS+ MolecularWeight: 172.31092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C[N+]1=C(SCC1)C

Isomeric SMILES

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

InChI

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