2-[4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(5-pyrrolidinosulfonyl-2-pyridyl)piperazino]isonicotinonitrile Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=NC=CC(=C4)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=NC=CC(=C4)C#N

InChI

InChI=1S/C19H22N6O2S/c20-14-16-5-6-21-19(13-16)24-11-9-23(10-12-24)18-4-3-17(15-22-18)28(26,27)25-7-1-2-8-25/h3-6,13,15H,1-2,7-12H2