3-piperazin-4-ium-1-yl-1,2-benzothiazole

Systemtic Name: 3-piperazin-4-ium-1-yl-1,2-benzothiazole Openeye Name: 3-piperazin-4-ium-1-yl-1,2-benzothiazole CAS Name: 3-(1-piperazin-4-iumyl)-1,2-benzothiazole IUPAC Name: 3-piperazin-4-ium-1-yl-1,2-benzothiazole Traditional Name: 3-piperazin-4-ium-1-yl-1,2-benzothiazole Formula: C11H14N3S+ MolecularWeight: 220.31396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NSC3=CC=CC=C32

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NSC3=CC=CC=C32

InChI

InChI=1S/C11H13N3S/c1-2-4-10-9(3-1)11(13-15-10)14-7-5-12-6-8-14/h1-4,12H,5-8H2/p+1