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

Systemtic Name: 2-octyl-5-[4-(4-pentylcyclohexyl)-3-propoxy-phenyl]-1,3,4-thiadiazole Openeye Name: 2-octyl-5-[4-(4-pentylcyclohexyl)-3-propoxy-phenyl]-1,3,4-thiadiazole CAS Name: 2-octyl-5-[4-(4-pentylcyclohexyl)-3-propoxyphenyl]-1,3,4-thiadiazole IUPAC Name: 2-octyl-5-[4-(4-pentylcyclohexyl)-3-propoxyphenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-(4-amylcyclohexyl)-3-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)C3CCC(CC3)CCCCC)OCCC

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)C2=CC(=C(C=C2)C3CCC(CC3)CCCCC)OCCC

InChI

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