4-[6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]sulfonylmorpholine Openeye Name: 4-[6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]sulfonylmorpholine CAS Name: 4-[[6-[4-(2-pyrimidinyl)-1-piperazinyl]-3-pyridin-1-iumyl]sulfonyl]morpholine IUPAC Name: 4-[6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]sulfonylmorpholine Traditional Name: 4-[6-[4-(2-pyrimidyl)piperazino]pyridin-1-ium-3-yl]sulfonylmorpholine Formula: C17H23N6O3S+ MolecularWeight: 391.46792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3)C4=NC=CC=N4

InChI

InChI=1S/C17H22N6O3S/c24-27(25,23-10-12-26-13-11-23)15-2-3-16(20-14-15)21-6-8-22(9-7-21)17-18-4-1-5-19-17/h1-5,14H,6-13H2/p+1