2-[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-2-keto-ethoxy]benzonitrile Formula: C17H16ClN3O4S2 MolecularWeight: 425.90964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H16ClN3O4S2/c18-15-5-6-17(26-15)27(23,24)21-9-7-20(8-10-21)16(22)12-25-14-4-2-1-3-13(14)11-19/h1-6H,7-10,12H2