4-[5-nitro-2-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]sulfonylmorpholine

Systemtic Name: 4-[5-nitro-2-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]sulfonylmorpholine Openeye Name: 4-[5-nitro-2-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]sulfonylmorpholine CAS Name: 4-[5-nitro-2-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[5-nitro-2-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]sulfonylmorpholine Traditional Name: 4-[5-nitro-2-[4-(2-pyrimidyl)piperazino]phenyl]sulfonylmorpholine Formula: C18H22N6O5S MolecularWeight: 434.46948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N6O5S/c25-24(26)15-2-3-16(17(14-15)30(27,28)23-10-12-29-13-11-23)21-6-8-22(9-7-21)18-19-4-1-5-20-18/h1-5,14H,6-13H2