4-[1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 4-[1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile Openeye Name: 4-[2-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-1-methyl-2-oxo-ethoxy]benzonitrile CAS Name: 4-[1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-1-oxopropan-2-yl]oxybenzonitrile IUPAC Name: 4-[1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-1-oxopropan-2-yl]oxybenzonitrile Traditional Name: 4-[2-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-2-keto-1-methyl-ethoxy]benzonitrile Formula: C20H19ClFN3O4S MolecularWeight: 451.898963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19ClFN3O4S/c1-14(29-16-4-2-15(13-23)3-5-16)20(26)24-8-10-25(11-9-24)30(27,28)17-6-7-19(22)18(21)12-17/h2-7,12,14H,8-11H2,1H3