3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-pyridin-3-yl-benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-pyridin-3-yl-benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(3-pyridyl)benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-(3-pyridinyl)benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-pyridin-3-ylbenzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-(3-pyridyl)benzamide Formula: C17H21N4O3S+ MolecularWeight: 361.43864

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CN=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CN=CC=C3

InChI

InChI=1S/C17H20N4O3S/c1-20-8-10-21(11-9-20)25(23,24)16-6-2-4-14(12-16)17(22)19-15-5-3-7-18-13-15/h2-7,12-13H,8-11H2,1H3,(H,19,22)/p+1