N-[5-(4-chloranyl-2-propyl-phenyl)-2-phenoxy-3H-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[5-(4-chloranyl-2-propyl-phenyl)-2-phenoxy-3H-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-(4-chloro-2-propyl-phenyl)-2-phenoxy-3H-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-(4-chloro-2-propylphenyl)-2-phenoxy-3H-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-(4-chloro-2-propylphenyl)-2-phenoxy-3H-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-(4-chloro-2-propyl-phenyl)-2-phenoxy-3H-1,3,4-thiadiazol-2-yl]acetamide Formula: C19H20ClN3O2S MolecularWeight: 389.899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)Cl)C2=NNC(S2)(NC(=O)C)OC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1)Cl)C2=NNC(S2)(NC(=O)C)OC3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3O2S/c1-3-7-14-12-15(20)10-11-17(14)18-22-23-19(26-18,21-13(2)24)25-16-8-5-4-6-9-16/h4-6,8-12,23H,3,7H2,1-2H3,(H,21,24)