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

Systemtic Name: 2-[4-[2-[4-(2-chlorophenyl)piperazin-1-yl]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[4-(2-chlorophenyl)piperazin-1-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[4-(2-chlorophenyl)-1-piperazinyl]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[4-(2-chlorophenyl)piperazin-1-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[4-(2-chlorophenyl)piperazino]acetyl]piperazino]sulfonylbenzonitrile Formula: C23H26ClN5O3S MolecularWeight: 488.00224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H26ClN5O3S/c24-20-6-2-3-7-21(20)27-11-9-26(10-12-27)18-23(30)28-13-15-29(16-14-28)33(31,32)22-8-4-1-5-19(22)17-25/h1-8H,9-16,18H2