2-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole CAS Name: 2-[1-(1,3-benzothiazol-2-ylmethyl)-4-piperidin-1-iumyl]-1,3-benzothiazole IUPAC Name: 2-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-4-yl]-1,3-benzothiazole Formula: C20H20N3S2+ MolecularWeight: 366.5229

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H19N3S2/c1-3-7-17-15(5-1)21-19(24-17)13-23-11-9-14(10-12-23)20-22-16-6-2-4-8-18(16)25-20/h1-8,14H,9-13H2/p+1