3-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]amino]benzenecarbonitrile

Systemtic Name: 3-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]amino]benzenecarbonitrile Openeye Name: 3-[[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]amino]benzonitrile CAS Name: 3-[[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]amino]benzonitrile IUPAC Name: 3-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]amino]benzonitrile Traditional Name: 3-[[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]amino]benzonitrile Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CNC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)CNC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H22N4O3S/c24-16-18-4-3-7-21(14-18)25-17-23(28)26-10-12-27(13-11-26)31(29,30)22-9-8-19-5-1-2-6-20(19)15-22/h1-9,14-15,25H,10-13,17H2