5-[(Z)-2-(4-butoxy-3-methoxy-phenyl)-1-chloranyl-ethenyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(Z)-2-(4-butoxy-3-methoxy-phenyl)-1-chloranyl-ethenyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[(Z)-2-(4-butoxy-3-methoxy-phenyl)-1-chloro-vinyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[(Z)-2-(4-butoxy-3-methoxyphenyl)-1-chloroethenyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[(Z)-2-(4-butoxy-3-methoxyphenyl)-1-chloroethenyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[(Z)-2-(4-butoxy-3-methoxy-phenyl)-1-chloro-vinyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C2=NN=C(S2)C(=O)NC3=CC=CC=C3)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(/C2=NN=C(S2)C(=O)NC3=CC=CC=C3)\Cl)OC

InChI

InChI=1S/C22H22ClN3O3S/c1-3-4-12-29-18-11-10-15(14-19(18)28-2)13-17(23)21-25-26-22(30-21)20(27)24-16-8-6-5-7-9-16/h5-11,13-14H,3-4,12H2,1-2H3,(H,24,27)/b17-13-