3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 3-[[4-(2-chlorophenyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-(2-chlorophenyl)piperazino]sulfonylbenzonitrile Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H16ClN3O2S/c18-16-6-1-2-7-17(16)20-8-10-21(11-9-20)24(22,23)15-5-3-4-14(12-15)13-19/h1-7,12H,8-11H2