N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-amine Traditional Name: 1,3-benzothiazol-2-ylmethyl-methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]amine Formula: C19H24N5O2S2+ MolecularWeight: 418.55616

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H23N5O2S2/c1-22-9-11-24(12-10-22)28(25,26)15-7-8-18(20-13-15)23(2)14-19-21-16-5-3-4-6-17(16)27-19/h3-8,13H,9-12,14H2,1-2H3/p+1