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

Systemtic Name: 2-hexyl-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole Openeye Name: 2-hexyl-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole CAS Name: 2-hexyl-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole IUPAC Name: 2-hexyl-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-(4-amylcyclohexyl)phenyl]-5-hexyl-1,3,4-thiadiazole Formula: C25H38N2S MolecularWeight: 398.64762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C3CCC(CC3)CCCCC

InChI

InChI=1S/C25H38N2S/c1-3-5-7-9-11-24-26-27-25(28-24)23-18-16-22(17-19-23)21-14-12-20(13-15-21)10-8-6-4-2/h16-21H,3-15H2,1-2H3