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

Systemtic Name: 2-nonyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole Openeye Name: 2-nonyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole CAS Name: 2-nonyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole IUPAC Name: 2-nonyl-5-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-[3-(4-amylcyclohexyl)propoxy]phenyl]-5-nonyl-1,3,4-thiadiazole Formula: C31H50N2OS MolecularWeight: 498.8065

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCC3CCC(CC3)CCCCC

InChI

InChI=1S/C31H50N2OS/c1-3-5-7-8-9-10-12-16-30-32-33-31(35-30)28-21-23-29(24-22-28)34-25-13-15-27-19-17-26(18-20-27)14-11-6-4-2/h21-24,26-27H,3-20,25H2,1-2H3