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

Systemtic Name: 4-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Openeye Name: 4-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole CAS Name: 4-methoxy-2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 4-methoxy-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Traditional Name: 4-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(C=CC=C3S2)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=C(C=CC=C3S2)OC

InChI

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