2-methyl-6-[4-[4-methyl-6-(4-methylpiperazin-4-ium-1-yl)pyrimidin-2-yl]piperazin-1-yl]sulfonyl-1,3-benzothiazole

Systemtic Name: 2-methyl-6-[4-[4-methyl-6-(4-methylpiperazin-4-ium-1-yl)pyrimidin-2-yl]piperazin-1-yl]sulfonyl-1,3-benzothiazole Openeye Name: 2-methyl-6-[4-[4-methyl-6-(4-methylpiperazin-4-ium-1-yl)pyrimidin-2-yl]piperazin-1-yl]sulfonyl-1,3-benzothiazole CAS Name: 2-methyl-6-[[4-[4-methyl-6-(4-methyl-1-piperazin-4-iumyl)-2-pyrimidinyl]-1-piperazinyl]sulfonyl]-1,3-benzothiazole IUPAC Name: 2-methyl-6-[4-[4-methyl-6-(4-methylpiperazin-4-ium-1-yl)pyrimidin-2-yl]piperazin-1-yl]sulfonyl-1,3-benzothiazole Traditional Name: 2-methyl-6-[4-[4-methyl-6-(4-methylpiperazin-4-ium-1-yl)pyrimidin-2-yl]piperazino]sulfonyl-1,3-benzothiazole Formula: C22H30N7O2S2+ MolecularWeight: 488.6493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N=C(S4)C)N5CC[NH+](CC5)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N=C(S4)C)N5CC[NH+](CC5)C

InChI

InChI=1S/C22H29N7O2S2/c1-16-14-21(27-8-6-26(3)7-9-27)25-22(23-16)28-10-12-29(13-11-28)33(30,31)18-4-5-19-20(15-18)32-17(2)24-19/h4-5,14-15H,6-13H2,1-3H3/p+1