2-[4-(5-chloranylthiophen-2-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(5-chloranylthiophen-2-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(5-chlorothiophene-2-carbonyl)piperazino]sulfonylbenzonitrile Formula: C16H14ClN3O3S2 MolecularWeight: 395.88366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(S2)Cl)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(S2)Cl)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C16H14ClN3O3S2/c17-15-6-5-13(24-15)16(21)19-7-9-20(10-8-19)25(22,23)14-4-2-1-3-12(14)11-18/h1-6H,7-10H2