2-[2-oxidanylidene-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-oxidanylidene-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzenecarbonitrile Openeye Name: 2-[2-oxo-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzonitrile CAS Name: 2-[2-oxo-2-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]ethoxy]benzonitrile IUPAC Name: 2-[2-oxo-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzonitrile Traditional Name: 2-[2-keto-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]ethoxy]benzonitrile Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC=C3C#N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=CC=C3C#N)C)C

InChI

InChI=1S/C23H27N3O4S/c1-16-13-17(2)19(4)23(18(16)3)31(28,29)26-11-9-25(10-12-26)22(27)15-30-21-8-6-5-7-20(21)14-24/h5-8,13H,9-12,15H2,1-4H3