6-[3-[3-oxidanyl-4,5,6-tris(phenylmethoxy)oxan-2-yl]oxypropyl]-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one

Systemtic Name: 6-[3-[3-oxidanyl-4,5,6-tris(phenylmethoxy)oxan-2-yl]oxypropyl]-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one Openeye Name: 5-tetradecyl-2-thioxo-6-[3-(4,5,6-tribenzyloxy-3-hydroxy-tetrahydropyran-2-yl)oxypropyl]-1H-pyrimidin-4-one CAS Name: 6-[3-[[3-hydroxy-4,5,6-tris(phenylmethoxy)-2-oxanyl]oxy]propyl]-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one IUPAC Name: 6-[3-[3-hydroxy-4,5,6-tris(phenylmethoxy)oxan-2-yl]oxypropyl]-2-sulfanylidene-5-tetradecyl-1H-pyrimidin-4-one Traditional Name: 5-myristyl-2-thioxo-6-[3-(4,5,6-tribenzoxy-3-hydroxy-tetrahydropyran-2-yl)oxypropyl]-1H-pyrimidin-4-one Formula: C47H64N2O7S MolecularWeight: 801.08526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=C(NC(=S)NC1=O)CCCOC2C(C(C(C(O2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)O

Isomeric SMILES

CCCCCCCCCCCCCCC1=C(NC(=S)NC1=O)CCCOC2C(C(C(C(O2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)O

InChI

InChI=1S/C47H64N2O7S/c1-2-3-4-5-6-7-8-9-10-11-12-22-30-39-40(48-47(57)49-44(39)51)31-23-32-52-45-41(50)42(53-33-36-24-16-13-17-25-36)43(54-34-37-26-18-14-19-27-37)46(56-45)55-35-38-28-20-15-21-29-38/h13-21,24-29,41-43,45-46,50H,2-12,22-23,30-35H2,1H3,(H2,48,49,51,57)