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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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