2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzothiazole

Systemtic Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzothiazole Openeye Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzothiazole CAS Name: 2-[2-(1-piperidin-1-iumyl)ethylthio]-1,3-benzothiazole IUPAC Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3-benzothiazole Traditional Name: 2-(2-piperidin-1-ium-1-ylethylthio)-1,3-benzothiazole Formula: C14H19N2S2+ MolecularWeight: 279.44406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC[NH+](CC1)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H18N2S2/c1-4-8-16(9-5-1)10-11-17-14-15-12-6-2-3-7-13(12)18-14/h2-3,6-7H,1,4-5,8-11H2/p+1