2,4-dimethyl-3-phenethyl-1,3-thiazol-3-ium

Systemtic Name: 2,4-dimethyl-3-phenethyl-1,3-thiazol-3-ium Openeye Name: 2,4-dimethyl-3-phenethyl-thiazol-3-ium CAS Name: 2,4-dimethyl-3-phenethylthiazol-3-ium IUPAC Name: 2,4-dimethyl-3-phenethyl-1,3-thiazol-3-ium Traditional Name: 2,4-dimethyl-3-phenethyl-thiazol-3-ium Formula: C13H16NS+ MolecularWeight: 218.33784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=[N+]1CCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CSC(=[N+]1CCC2=CC=CC=C2)C

InChI

InChI=1S/C13H16NS/c1-11-10-15-12(2)14(11)9-8-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3/q+1