2-[2-[4-(phenylsulfonyl)piperazin-1-yl]carbonylphenyl]sulfanylbenzenecarbonitrile

Systemtic Name: 2-[2-[4-(phenylsulfonyl)piperazin-1-yl]carbonylphenyl]sulfanylbenzenecarbonitrile Openeye Name: 2-[2-[4-(benzenesulfonyl)piperazine-1-carbonyl]phenyl]sulfanylbenzonitrile CAS Name: 2-[[2-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]phenyl]thio]benzonitrile IUPAC Name: 2-[2-[4-(benzenesulfonyl)piperazine-1-carbonyl]phenyl]sulfanylbenzonitrile Traditional Name: 2-[[2-(4-besylpiperazine-1-carbonyl)phenyl]thio]benzonitrile Formula: C24H21N3O3S2 MolecularWeight: 463.57184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3S2/c25-18-19-8-4-6-12-22(19)31-23-13-7-5-11-21(23)24(28)26-14-16-27(17-15-26)32(29,30)20-9-2-1-3-10-20/h1-13H,14-17H2