N,N-dimethyl-6-oxidanylidene-1-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyridine-3-sulfonamide

Systemtic Name: N,N-dimethyl-6-oxidanylidene-1-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyridine-3-sulfonamide Openeye Name: N,N-dimethyl-6-oxo-1-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyridine-3-sulfonamide CAS Name: N,N-dimethyl-6-oxo-1-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-3-pyridinesulfonamide IUPAC Name: N,N-dimethyl-6-oxo-1-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]pyridine-3-sulfonamide Traditional Name: 6-keto-N,N-dimethyl-1-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]pyridine-3-sulfonamide Formula: C16H23N6O3S+ MolecularWeight: 379.45722

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)C[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)C[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H22N6O3S/c1-19(2)26(24,25)14-4-5-15(23)22(12-14)13-20-8-10-21(11-9-20)16-17-6-3-7-18-16/h3-7,12H,8-11,13H2,1-2H3/p+1