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

Systemtic Name: 4-chloranyl-2-piperazin-4-ium-1-yl-1,3-benzothiazole Openeye Name: 4-chloro-2-piperazin-4-ium-1-yl-1,3-benzothiazole CAS Name: 4-chloro-2-(1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 4-chloro-2-piperazin-4-ium-1-yl-1,3-benzothiazole Traditional Name: 4-chloro-2-piperazin-4-ium-1-yl-1,3-benzothiazole Formula: C11H13ClN3S+ MolecularWeight: 254.75902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C11H12ClN3S/c12-8-2-1-3-9-10(8)14-11(16-9)15-6-4-13-5-7-15/h1-3,13H,4-7H2/p+1