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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

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