2-[4-[[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]methyl]phenyl]benzonitrile Formula: C22H20ClN3O2S2 MolecularWeight: 457.9961

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H20ClN3O2S2/c23-21-9-10-22(29-21)30(27,28)26-13-11-25(12-14-26)16-17-5-7-18(8-6-17)20-4-2-1-3-19(20)15-24/h1-10H,11-14,16H2