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

Systemtic Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[4-(3-chlorophenyl)piperazin-1-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[4-(3-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=C4)Cl

Isomeric SMILES

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

InChI

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