2-hexyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole

Systemtic Name: 2-hexyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole Openeye Name: 2-hexyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole CAS Name: 2-hexyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole IUPAC Name: 2-hexyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-[3-(4-amylcyclohexyl)propoxy]phenyl]-5-hexyl-1,3,4-thiadiazole Formula: C28H44N2OS MolecularWeight: 456.72676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCCC

InChI

InChI=1S/C28H44N2OS/c1-3-5-7-9-13-27-29-30-28(32-27)25-18-20-26(21-19-25)31-22-10-12-24-16-14-23(15-17-24)11-8-6-4-2/h18-21,23-24H,3-17,22H2,1-2H3