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

Systemtic Name: 6-chloranyl-4-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Openeye Name: 6-chloro-4-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole CAS Name: 6-chloro-4-methyl-2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazole IUPAC Name: 6-chloro-4-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Traditional Name: 6-chloro-4-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazole Formula: C13H17ClN3S+ MolecularWeight: 282.81218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N3CC[NH+](CC3)C)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N3CC[NH+](CC3)C)Cl

InChI

InChI=1S/C13H16ClN3S/c1-9-7-10(14)8-11-12(9)15-13(18-11)17-5-3-16(2)4-6-17/h7-8H,3-6H2,1-2H3/p+1