5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-phenyl-2-(phenylsulfonyl)pentanenitrile

Systemtic Name: 5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-phenyl-2-(phenylsulfonyl)pentanenitrile Openeye Name: 2-(benzenesulfonyl)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-phenyl-pentanenitrile CAS Name: 2-(benzenesulfonyl)-5-[4-(2-hydroxyethyl)-1-piperazinyl]-2-phenylpentanenitrile IUPAC Name: 2-(benzenesulfonyl)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-phenylpentanenitrile Traditional Name: 2-besyl-5-[4-(2-hydroxyethyl)piperazino]-2-phenyl-valeronitrile Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(C#N)(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CCO

Isomeric SMILES

C1CN(CCN1CCCC(C#N)(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CCO

InChI

InChI=1S/C23H29N3O3S/c24-20-23(21-8-3-1-4-9-21,30(28,29)22-10-5-2-6-11-22)12-7-13-25-14-16-26(17-15-25)18-19-27/h1-6,8-11,27H,7,12-19H2