2-chloranyl-6-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenoxy]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenoxy]benzenecarbonitrile Openeye Name: 2-chloro-6-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenoxy]benzonitrile CAS Name: 2-chloro-6-[4-[[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl]phenoxy]benzonitrile IUPAC Name: 2-chloro-6-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenoxy]benzonitrile Traditional Name: 2-chloro-6-[4-(4-o-phenetylpiperazino)sulfonylphenoxy]benzonitrile Formula: C25H24ClN3O4S MolecularWeight: 497.99376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N

InChI

InChI=1S/C25H24ClN3O4S/c1-2-32-25-8-4-3-7-23(25)28-14-16-29(17-15-28)34(30,31)20-12-10-19(11-13-20)33-24-9-5-6-22(26)21(24)18-27/h3-13H,2,14-17H2,1H3