6-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-(4-benzofurazan-4-ylsulfonylpiperazino)nicotinonitrile Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC4=NON=C43

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC4=NON=C43

InChI

InChI=1S/C16H14N6O3S/c17-10-12-4-5-15(18-11-12)21-6-8-22(9-7-21)26(23,24)14-3-1-2-13-16(14)20-25-19-13/h1-5,11H,6-9H2