2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-[4-(2-pyrimidyl)piperazino]sulfonylbenzonitrile Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C15H15N5O2S/c16-12-13-4-1-2-5-14(13)23(21,22)20-10-8-19(9-11-20)15-17-6-3-7-18-15/h1-7H,8-11H2