2-[4-[2-(3,4-dichlorophenyl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(3,4-dichlorophenyl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(3,4-dichlorophenyl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(3,4-dichlorophenyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(3,4-dichlorophenyl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(3,4-dichlorophenyl)acetyl]piperazino]sulfonylbenzonitrile Formula: C19H17Cl2N3O3S MolecularWeight: 438.32758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C19H17Cl2N3O3S/c20-16-6-5-14(11-17(16)21)12-19(25)23-7-9-24(10-8-23)28(26,27)18-4-2-1-3-15(18)13-22/h1-6,11H,7-10,12H2