1-[(3aR,5S,6S,6aR)-5-[(1R)-1,2-dipropoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-3-[4-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(3aR,5S,6S,6aR)-5-[(1R)-1,2-dipropoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-3-[4-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(3aR,5S,6S,6aR)-5-[(1R)-1,2-dipropoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-3-[4-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[(3aR,5S,6S,6aR)-5-[(1R)-1,2-dipropoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-3-[4-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(3aR,5S,6S,6aR)-5-[(1R)-1,2-dipropoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-3-[4-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(3aR,5S,6S,6aR)-5-[(1R)-1,2-dipropoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-3-[4-(trifluoromethyl)phenyl]thiourea Formula: C23H33F3N2O5S MolecularWeight: 506.57873

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCC(C1C(C2C(O1)OC(O2)(C)C)NC(=S)NC3=CC=C(C=C3)C(F)(F)F)OCCC

Isomeric SMILES

CCCOC[C@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)NC(=S)NC3=CC=C(C=C3)C(F)(F)F)OCCC

InChI

InChI=1S/C23H33F3N2O5S/c1-5-11-29-13-16(30-12-6-2)18-17(19-20(31-18)33-22(3,4)32-19)28-21(34)27-15-9-7-14(8-10-15)23(24,25)26/h7-10,16-20H,5-6,11-13H2,1-4H3,(H2,27,28,34)/t16-,17+,18-,19-,20-/m1/s1