5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-fluoro-4-methoxyphenyl)methylthio]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-N-(3-methoxyphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-fluoro-4-methoxy-benzyl)thio]-1,3,4-thiadiazol-2-yl]-(3-methoxyphenyl)amine Formula: C17H16FN3O2S2 MolecularWeight: 377.456243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(S2)NC3=CC(=CC=C3)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(S2)NC3=CC(=CC=C3)OC)F

InChI

InChI=1S/C17H16FN3O2S2/c1-22-13-5-3-4-12(9-13)19-16-20-21-17(25-16)24-10-11-6-7-15(23-2)14(18)8-11/h3-9H,10H2,1-2H3,(H,19,20)