[(1S,2S,3R,4S,6S)-4-oxidanyl-2,6-dipyridin-3-yl-4-pyridin-4-yl-3-pyridin-4-ylcarbonyl-cyclohexyl]-pyridin-4-yl-methanone

Systemtic Name: [(1S,2S,3R,4S,6S)-4-oxidanyl-2,6-dipyridin-3-yl-4-pyridin-4-yl-3-pyridin-4-ylcarbonyl-cyclohexyl]-pyridin-4-yl-methanone Openeye Name: [(1S,2S,3R,4S,6S)-4-hydroxy-3-(pyridine-4-carbonyl)-2,6-bis(3-pyridyl)-4-(4-pyridyl)cyclohexyl]-(4-pyridyl)methanone CAS Name: [(1S,2S,3R,4S,6S)-4-hydroxy-3-[oxo(pyridin-4-yl)methyl]-2,6-bis(3-pyridinyl)-4-pyridin-4-ylcyclohexyl]-pyridin-4-ylmethanone IUPAC Name: [(1S,2S,3R,4S,6S)-4-hydroxy-3-(pyridine-4-carbonyl)-2,6-dipyridin-3-yl-4-pyridin-4-ylcyclohexyl]-pyridin-4-ylmethanone Traditional Name: [(1S,2S,3R,4S,6S)-4-hydroxy-3-isonicotinoyl-2,6-bis(3-pyridyl)-4-(4-pyridyl)cyclohexyl]-(4-pyridyl)methanone Formula: C33H27N5O3 MolecularWeight: 541.59918

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C1(C2=CC=NC=C2)O)C(=O)C3=CC=NC=C3)C4=CN=CC=C4)C(=O)C5=CC=NC=C5)C6=CN=CC=C6

Isomeric SMILES

C1[C@@H]([C@@H]([C@@H]([C@H]([C@@]1(C2=CC=NC=C2)O)C(=O)C3=CC=NC=C3)C4=CN=CC=C4)C(=O)C5=CC=NC=C5)C6=CN=CC=C6

InChI

InChI=1S/C33H27N5O3/c39-31(22-5-13-34-14-6-22)29-27(24-3-1-11-37-20-24)19-33(41,26-9-17-36-18-10-26)30(28(29)25-4-2-12-38-21-25)32(40)23-7-15-35-16-8-23/h1-18,20-21,27-30,41H,19H2/t27-,28+,29+,30+,33-/m1/s1