[4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate

Systemtic Name: [4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate Openeye Name: [4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate CAS Name: (E)-2-hexenoic acid [4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] ester IUPAC Name: [4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate Traditional Name: (E)-hex-2-enoic acid [4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] ester Formula: C20H26N2O2S MolecularWeight: 358.49764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OC(=O)C=CCCC

Isomeric SMILES

CCCCCCC1=NN=C(S1)C2=CC=C(C=C2)OC(=O)/C=C/CCC

InChI

InChI=1S/C20H26N2O2S/c1-3-5-7-9-10-18-21-22-20(25-18)16-12-14-17(15-13-16)24-19(23)11-8-6-4-2/h8,11-15H,3-7,9-10H2,1-2H3/b11-8+