4-methyl-1,3-thiazol-3-ium-3-amine; 1,3,5-trimethylbenzene

Systemtic Name: 4-methyl-1,3-thiazol-3-ium-3-amine; 1,3,5-trimethylbenzene Openeye Name: mesitylene; 4-methylthiazol-3-ium-3-amine CAS Name: 4-methyl-3-thiazol-3-iumamine; 1,3,5-trimethylbenzene IUPAC Name: 4-methyl-1,3-thiazol-3-ium-3-amine; 1,3,5-trimethylbenzene Traditional Name: mesitylene; (4-methylthiazol-3-ium-3-yl)amine Formula: C13H19N2S+ MolecularWeight: 235.36836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C)C.CC1=CSC=[N+]1N

Isomeric SMILES

CC1=CC(=CC(=C1)C)C.CC1=CSC=[N+]1N

InChI

InChI=1S/C9H12.C4H7N2S/c1-7-4-8(2)6-9(3)5-7;1-4-2-7-3-6(4)5/h4-6H,1-3H3;2-3H,5H2,1H3/q;+1