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

Systemtic Name: 2-(4-heptylphenyl)-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole Openeye Name: 2-(4-heptylphenyl)-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole CAS Name: 2-(4-heptylphenyl)-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole IUPAC Name: 2-(4-heptylphenyl)-5-[4-(4-pentylcyclohexyl)phenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-(4-amylcyclohexyl)phenyl]-5-(4-heptylphenyl)-1,3,4-thiadiazole Formula: C32H44N2S MolecularWeight: 488.77016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)C4CCC(CC4)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)C4CCC(CC4)CCCCC

InChI

InChI=1S/C32H44N2S/c1-3-5-7-8-10-12-26-15-19-29(20-16-26)31-33-34-32(35-31)30-23-21-28(22-24-30)27-17-13-25(14-18-27)11-9-6-4-2/h15-16,19-25,27H,3-14,17-18H2,1-2H3