4-[4-[2,5-bis(chloranyl)thiophen-3-yl]sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[2,5-bis(chloranyl)thiophen-3-yl]sulfonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[(2,5-dichloro-3-thienyl)sulfonyl]piperazin-1-yl]benzonitrile CAS Name: 4-[4-[(2,5-dichloro-3-thiophenyl)sulfonyl]-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-(2,5-dichlorothiophen-3-yl)sulfonylpiperazin-1-yl]benzonitrile Traditional Name: 4-[4-[(2,5-dichloro-3-thienyl)sulfonyl]piperazino]benzonitrile Formula: C15H13Cl2N3O2S2 MolecularWeight: 402.31862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)S(=O)(=O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)S(=O)(=O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C15H13Cl2N3O2S2/c16-14-9-13(15(17)23-14)24(21,22)20-7-5-19(6-8-20)12-3-1-11(10-18)2-4-12/h1-4,9H,5-8H2