2-(4-hexoxyphenyl)-5-octyl-1,3,4-thiadiazole

Systemtic Name: 2-(4-hexoxyphenyl)-5-octyl-1,3,4-thiadiazole Openeye Name: 2-(4-hexoxyphenyl)-5-octyl-1,3,4-thiadiazole CAS Name: 2-(4-hexoxyphenyl)-5-octyl-1,3,4-thiadiazole IUPAC Name: 2-(4-hexoxyphenyl)-5-octyl-1,3,4-thiadiazole Traditional Name: 2-(4-hexoxyphenyl)-5-octyl-1,3,4-thiadiazole Formula: C22H34N2OS MolecularWeight: 374.58316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCCCC

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OCCCCCC

InChI

InChI=1S/C22H34N2OS/c1-3-5-7-9-10-11-13-21-23-24-22(26-21)19-14-16-20(17-15-19)25-18-12-8-6-4-2/h14-17H,3-13,18H2,1-2H3