4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-(2-cyanoethyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(2-cyanoethyl)piperazino]sulfonylbenzonitrile Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CN(CCN1CCC#N)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H16N4O2S/c15-6-1-7-17-8-10-18(11-9-17)21(19,20)14-4-2-13(12-16)3-5-14/h2-5H,1,7-11H2