2-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]pyrimidine Traditional Name: 2-(4-besylpiperazino)pyrimidine Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H16N4O2S/c19-21(20,13-5-2-1-3-6-13)18-11-9-17(10-12-18)14-15-7-4-8-16-14/h1-8H,9-12H2