4-(4-methylphenyl)-2-pyrrolidin-1-ium-1-yl-1,3-thiazole bromide

Systemtic Name: 4-(4-methylphenyl)-2-pyrrolidin-1-ium-1-yl-1,3-thiazole bromide Openeye Name: 4-(p-tolyl)-2-pyrrolidin-1-ium-1-yl-thiazole bromide CAS Name: 4-(4-methylphenyl)-2-(1-pyrrolidin-1-iumyl)thiazole bromide IUPAC Name: 4-(4-methylphenyl)-2-pyrrolidin-1-ium-1-yl-1,3-thiazole bromide Traditional Name: 4-(p-tolyl)-2-pyrrolidin-1-ium-1-yl-thiazole bromide Formula: C14H17BrN2S MolecularWeight: 325.26718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)[NH+]3CCCC3.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)[NH+]3CCCC3.[Br-]

InChI

InChI=1S/C14H16N2S.BrH/c1-11-4-6-12(7-5-11)13-10-17-14(15-13)16-8-2-3-9-16;/h4-7,10H,2-3,8-9H2,1H3;1H