(3aR,4R,7S,7aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6,6-bis(methylsulfanyl)-7-(trifluoromethyl)-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran

Systemtic Name: (3aR,4R,7S,7aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6,6-bis(methylsulfanyl)-7-(trifluoromethyl)-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran Openeye Name: (3aR,4R,7S,7aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6,6-bis(methylsulfanyl)-7-(trifluoromethyl)-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran CAS Name: (3aR,4R,7S,7aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6,6-bis(methylthio)-7-(trifluoromethyl)-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran IUPAC Name: (3aR,4R,7S,7aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6,6-bis(methylsulfanyl)-7-(trifluoromethyl)-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran Traditional Name: (3aR,4R,7S,7aR)-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-6,6-bis(methylthio)-7-(trifluoromethyl)-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran Formula: C16H25F3O5S2 MolecularWeight: 418.49191

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2C3C(C(C(O2)(SC)SC)C(F)(F)F)OC(O3)(C)C)C

Isomeric SMILES

CC1(OC[C@@H](O1)[C@@H]2[C@H]3[C@@H]([C@H](C(O2)(SC)SC)C(F)(F)F)OC(O3)(C)C)C

InChI

InChI=1S/C16H25F3O5S2/c1-13(2)20-7-8(21-13)9-10-11(23-14(3,4)22-10)12(15(17,18)19)16(24-9,25-5)26-6/h8-12H,7H2,1-6H3/t8-,9-,10+,11+,12+/m1/s1