4-[2-oxidanylidene-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-oxidanylidene-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-oxo-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethoxy]benzonitrile IUPAC Name: 4-[2-oxo-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethoxy]benzonitrile Traditional Name: 4-[2-keto-2-(4-p-cumenylsulfonylpiperazino)ethoxy]benzonitrile Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H25N3O4S/c1-17(2)19-5-9-21(10-6-19)30(27,28)25-13-11-24(12-14-25)22(26)16-29-20-7-3-18(15-23)4-8-20/h3-10,17H,11-14,16H2,1-2H3