[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]methanone Formula: C24H29N4O3S2+ MolecularWeight: 485.64206

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H28N4O3S2/c1-26-13-15-28(16-14-26)33(30,31)20-6-4-5-19(17-20)24(29)27-11-9-18(10-12-27)23-25-21-7-2-3-8-22(21)32-23/h2-8,17-18H,9-16H2,1H3/p+1