2-heptyl-5-(4-octoxyphenyl)-1,3,4-thiadiazole

Systemtic Name: 2-heptyl-5-(4-octoxyphenyl)-1,3,4-thiadiazole Openeye Name: 2-heptyl-5-(4-octoxyphenyl)-1,3,4-thiadiazole CAS Name: 2-heptyl-5-(4-octoxyphenyl)-1,3,4-thiadiazole IUPAC Name: 2-heptyl-5-(4-octoxyphenyl)-1,3,4-thiadiazole Traditional Name: 2-heptyl-5-(4-octoxyphenyl)-1,3,4-thiadiazole Formula: C23H36N2OS MolecularWeight: 388.60974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)CCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)CCCCCCC

InChI

InChI=1S/C23H36N2OS/c1-3-5-7-9-11-13-19-26-21-17-15-20(16-18-21)23-25-24-22(27-23)14-12-10-8-6-4-2/h15-18H,3-14,19H2,1-2H3