2-[4-(4-cyanophenyl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(4-cyanophenyl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(4-cyanobenzoyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(4-cyanophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(4-cyanobenzoyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(4-cyanobenzoyl)piperazino]sulfonylbenzonitrile Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C19H16N4O3S/c20-13-15-5-7-16(8-6-15)19(24)22-9-11-23(12-10-22)27(25,26)18-4-2-1-3-17(18)14-21/h1-8H,9-12H2