4-(pyridin-2-yldisulfanyl)-1-[4-(6-pyridin-2-ylpyridin-3-yl)carbonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-(pyridin-2-yldisulfanyl)-1-[4-(6-pyridin-2-ylpyridin-3-yl)carbonylpiperazin-1-yl]butan-1-one Openeye Name: 4-(2-pyridyldisulfanyl)-1-[4-[6-(2-pyridyl)pyridine-3-carbonyl]piperazin-1-yl]butan-1-one CAS Name: 1-[4-[oxo-[6-(2-pyridinyl)-3-pyridinyl]methyl]-1-piperazinyl]-4-(2-pyridinyldisulfanyl)-1-butanone IUPAC Name: 4-(pyridin-2-yldisulfanyl)-1-[4-(6-pyridin-2-ylpyridine-3-carbonyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(2-pyridyldisulfanyl)-1-[4-[6-(2-pyridyl)nicotinoyl]piperazino]butan-1-one Formula: C24H25N5O2S2 MolecularWeight: 479.6176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCSSC2=CC=CC=N2)C(=O)C3=CN=C(C=C3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C(=O)CCCSSC2=CC=CC=N2)C(=O)C3=CN=C(C=C3)C4=CC=CC=N4

InChI

InChI=1S/C24H25N5O2S2/c30-23(8-5-17-32-33-22-7-2-4-12-26-22)28-13-15-29(16-14-28)24(31)19-9-10-21(27-18-19)20-6-1-3-11-25-20/h1-4,6-7,9-12,18H,5,8,13-17H2