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

Systemtic Name: 4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 4-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 4-[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=C(C=C3)C#N

Isomeric SMILES

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

InChI

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