2-[4-[4-[(E)-but-2-enoxy]phenyl]phenyl]-5-octyl-1,3,4-thiadiazole

Systemtic Name: 2-[4-[4-[(E)-but-2-enoxy]phenyl]phenyl]-5-octyl-1,3,4-thiadiazole Openeye Name: 2-[4-[4-[(E)-but-2-enoxy]phenyl]phenyl]-5-octyl-1,3,4-thiadiazole CAS Name: 2-[4-[4-[(E)-but-2-enoxy]phenyl]phenyl]-5-octyl-1,3,4-thiadiazole IUPAC Name: 2-[4-[4-[(E)-but-2-enoxy]phenyl]phenyl]-5-octyl-1,3,4-thiadiazole Traditional Name: 2-[4-[4-[(E)-but-2-enoxy]phenyl]phenyl]-5-octyl-1,3,4-thiadiazole Formula: C26H32N2OS MolecularWeight: 420.61008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC=CC

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC/C=C/C

InChI

InChI=1S/C26H32N2OS/c1-3-5-7-8-9-10-11-25-27-28-26(30-25)23-14-12-21(13-15-23)22-16-18-24(19-17-22)29-20-6-4-2/h4,6,12-19H,3,5,7-11,20H2,1-2H3/b6-4+