1-[(2R,4aR,6R,7R,8S,8aR)-8-(4-methylphenyl)sulfanyl-7-oxidanyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,4aR,6R,7R,8S,8aR)-8-(4-methylphenyl)sulfanyl-7-oxidanyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,4aR,6R,7R,8S,8aR)-7-hydroxy-2-phenyl-8-(p-tolylsulfanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,4aR,6R,7R,8S,8aR)-7-hydroxy-8-[(4-methylphenyl)thio]-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,4aR,6R,7R,8S,8aR)-7-hydroxy-8-(4-methylphenyl)sulfanyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,4aR,6R,7R,8S,8aR)-7-hydroxy-2-phenyl-8-(p-tolylthio)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C25H26N2O6S MolecularWeight: 482.54874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2C(C(OC3C2OC(OC3)C4=CC=CC=C4)N5C=C(C(=O)NC5=O)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S[C@H]2[C@@H]([C@@H](O[C@H]3[C@H]2O[C@@H](OC3)C4=CC=CC=C4)N5C=C(C(=O)NC5=O)C)O

InChI

InChI=1S/C25H26N2O6S/c1-14-8-10-17(11-9-14)34-21-19(28)23(27-12-15(2)22(29)26-25(27)30)32-18-13-31-24(33-20(18)21)16-6-4-3-5-7-16/h3-12,18-21,23-24,28H,13H2,1-2H3,(H,26,29,30)/t18-,19+,20-,21+,23-,24-/m1/s1