2-methyl-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzothiazole

Systemtic Name: 2-methyl-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzothiazole Openeye Name: 2-methyl-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzothiazole CAS Name: 2-methyl-6-(1-pyrrolidin-1-iumylmethyl)-1,3-benzothiazole IUPAC Name: 2-methyl-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzothiazole Traditional Name: 2-methyl-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzothiazole Formula: C13H17N2S+ MolecularWeight: 233.35248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C13H16N2S/c1-10-14-12-5-4-11(8-13(12)16-10)9-15-6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3/p+1