2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]benzonitrile CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]benzonitrile Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]benzonitrile Formula: C15H14BrN3O2S2 MolecularWeight: 412.32456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C15H14BrN3O2S2/c16-14-5-6-15(22-14)23(20,21)19-9-7-18(8-10-19)13-4-2-1-3-12(13)11-17/h1-6H,7-10H2