3-[[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]amino]benzenecarbonitrile

Systemtic Name: 3-[[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]amino]benzenecarbonitrile Openeye Name: 3-[[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl]amino]benzonitrile CAS Name: 3-[[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl]amino]benzonitrile IUPAC Name: 3-[[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]amino]benzonitrile Traditional Name: 3-[[2-(4-besylpiperazino)-2-keto-ethyl]amino]benzonitrile Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CNC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O3S/c20-14-16-5-4-6-17(13-16)21-15-19(24)22-9-11-23(12-10-22)27(25,26)18-7-2-1-3-8-18/h1-8,13,21H,9-12,15H2