4-[[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]sulfonylmethyl]benzenecarbonitrile Openeye Name: 4-[[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]sulfonylmethyl]benzonitrile CAS Name: 4-[[2-[4-(4-cyanophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]sulfonylmethyl]benzonitrile IUPAC Name: 4-[[2-[4-(4-cyanophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]sulfonylmethyl]benzonitrile Traditional Name: 4-[[2-[4-(4-cyanophenyl)sulfonylpiperazino]-2-keto-ethyl]sulfonylmethyl]benzonitrile Formula: C21H20N4O5S2 MolecularWeight: 472.5373

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CS(=O)(=O)CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)CS(=O)(=O)CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H20N4O5S2/c22-13-17-1-3-19(4-2-17)15-31(27,28)16-21(26)24-9-11-25(12-10-24)32(29,30)20-7-5-18(14-23)6-8-20/h1-8H,9-12,15-16H2