3-[6-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-2-yl]propylazanium

Systemtic Name: 3-[6-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-2-yl]propylazanium Openeye Name: 3-[6-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-2-yl]propylammonium CAS Name: 3-[6-(4-methyl-1-piperazin-4-iumyl)-1,3-benzothiazol-2-yl]propylammonium IUPAC Name: 3-[6-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-2-yl]propylazanium Traditional Name: 3-[6-(4-methylpiperazin-4-ium-1-yl)-1,3-benzothiazol-2-yl]propylammonium Formula: C15H24N4S+2 MolecularWeight: 292.44286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC3=C(C=C2)N=C(S3)CCC[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC3=C(C=C2)N=C(S3)CCC[NH3+]

InChI

InChI=1S/C15H22N4S/c1-18-7-9-19(10-8-18)12-4-5-13-14(11-12)20-15(17-13)3-2-6-16/h4-5,11H,2-3,6-10,16H2,1H3/p+2