4-[4-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[2-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-2-oxoethoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxoethoxy]phenyl]benzonitrile Traditional Name: 4-[4-[2-[4-(2-chlorophenyl)sulfonylpiperazino]-2-keto-ethoxy]phenyl]benzonitrile Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H22ClN3O4S/c26-23-3-1-2-4-24(23)34(31,32)29-15-13-28(14-16-29)25(30)18-33-22-11-9-21(10-12-22)20-7-5-19(17-27)6-8-20/h1-12H,13-16,18H2