2-[4-[4-[(E)-hept-2-enoxy]phenyl]phenyl]-5-pentyl-1,3,4-thiadiazole

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCC=CCCCC

Isomeric SMILES

CCCCCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC/C=C/CCCC

InChI

InChI=1S/C26H32N2OS/c1-3-5-7-8-10-20-29-24-18-16-22(17-19-24)21-12-14-23(15-13-21)26-28-27-25(30-26)11-9-6-4-2/h8,10,12-19H,3-7,9,11,20H2,1-2H3/b10-8+