2-[4-[2-(4-ethanoylpiperazin-1-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(4-ethanoylpiperazin-1-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(4-acetylpiperazin-1-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(4-acetyl-1-piperazinyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(4-acetylpiperazin-1-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(4-acetylpiperazino)acetyl]piperazino]sulfonylbenzonitrile Formula: C19H25N5O4S MolecularWeight: 419.4979

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC(=O)N1CCN(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C19H25N5O4S/c1-16(25)22-8-6-21(7-9-22)15-19(26)23-10-12-24(13-11-23)29(27,28)18-5-3-2-4-17(18)14-20/h2-5H,6-13,15H2,1H3