6-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole

Systemtic Name: 6-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Openeye Name: 6-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole CAS Name: 6-methoxy-2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 6-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Traditional Name: 6-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Formula: C13H18N3OS+ MolecularWeight: 264.36652

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C13H17N3OS/c1-15-5-7-16(8-6-15)13-14-11-4-3-10(17-2)9-12(11)18-13/h3-4,9H,5-8H2,1-2H3/p+1