4-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[4-(3-cyano-2-pyridyl)piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[4-(3-cyano-2-pyridinyl)-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[4-(3-cyano-2-pyridyl)piperazino]sulfonylbenzenesulfonamide Formula: C16H17N5O4S2 MolecularWeight: 407.46728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)C#N)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)C#N)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H17N5O4S2/c17-12-13-2-1-7-19-16(13)20-8-10-21(11-9-20)27(24,25)15-5-3-14(4-6-15)26(18,22)23/h1-7H,8-11H2,(H2,18,22,23)