6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-8-[[(1S,5R)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methyl]chromen-4-one

Systemtic Name: 6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-8-[[(1S,5R)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methyl]chromen-4-one Openeye Name: 6-ethyl-7-hydroxy-3-(4-methylthiazol-2-yl)-8-[[(1S,5R)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methyl]chromen-4-one CAS Name: 6-ethyl-7-hydroxy-3-(4-methyl-2-thiazolyl)-8-[[(1S,5R)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methyl]-1-benzopyran-4-one IUPAC Name: 6-ethyl-7-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)-8-[[(1S,5R)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methyl]chromen-4-one Traditional Name: 6-ethyl-7-hydroxy-3-(4-methylthiazol-2-yl)-8-[[(1S,5R)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methyl]chromone Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)CN4CC5(CC4CC(C5)(C)C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)CN4C[C@]5(C[C@@H]4CC(C5)(C)C)C)O

InChI

InChI=1S/C26H32N2O3S/c1-6-16-7-18-22(30)20(24-27-15(2)12-32-24)11-31-23(18)19(21(16)29)10-28-14-26(5)9-17(28)8-25(3,4)13-26/h7,11-12,17,29H,6,8-10,13-14H2,1-5H3/t17-,26-/m0/s1