2,5-bis(6-dodecoxy-2-fluoranyl-pyridin-3-yl)-1,3,4-thiadiazole

Systemtic Name: 2,5-bis(6-dodecoxy-2-fluoranyl-pyridin-3-yl)-1,3,4-thiadiazole Openeye Name: 2,5-bis(6-dodecoxy-2-fluoro-3-pyridyl)-1,3,4-thiadiazole CAS Name: 2,5-bis(6-dodecoxy-2-fluoro-3-pyridinyl)-1,3,4-thiadiazole IUPAC Name: 2,5-bis(6-dodecoxy-2-fluoropyridin-3-yl)-1,3,4-thiadiazole Traditional Name: 2,5-bis(2-fluoro-6-lauryloxy-3-pyridyl)-1,3,4-thiadiazole Formula: C36H54F2N4O2S MolecularWeight: 644.901366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=NC(=C(C=C1)C2=NN=C(S2)C3=C(N=C(C=C3)OCCCCCCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCCCCCOC1=NC(=C(C=C1)C2=NN=C(S2)C3=C(N=C(C=C3)OCCCCCCCCCCCC)F)F

InChI

InChI=1S/C36H54F2N4O2S/c1-3-5-7-9-11-13-15-17-19-21-27-43-31-25-23-29(33(37)39-31)35-41-42-36(45-35)30-24-26-32(40-34(30)38)44-28-22-20-18-16-14-12-10-8-6-4-2/h23-26H,3-22,27-28H2,1-2H3