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

Systemtic Name: 2-octyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole Openeye Name: 2-octyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole CAS Name: 2-octyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole IUPAC Name: 2-octyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-[3-(4-amylcyclohexyl)propoxy]phenyl]-5-octyl-1,3,4-thiadiazole Formula: C30H48N2OS MolecularWeight: 484.77992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCCC

InChI

InChI=1S/C30H48N2OS/c1-3-5-7-8-9-11-15-29-31-32-30(34-29)27-20-22-28(23-21-27)33-24-12-14-26-18-16-25(17-19-26)13-10-6-4-2/h20-23,25-26H,3-19,24H2,1-2H3