5-[3-(4-chloranylphenoxy)propylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[3-(4-chloranylphenoxy)propylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[3-(4-chlorophenoxy)propylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[3-(4-chlorophenoxy)propylthio]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[3-(4-chlorophenoxy)propylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[3-(4-chlorophenoxy)propylthio]-1,3,4-thiadiazol-2-yl]-(4-methoxyphenyl)amine Formula: C18H18ClN3O2S2 MolecularWeight: 407.93742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O2S2/c1-23-15-9-5-14(6-10-15)20-17-21-22-18(26-17)25-12-2-11-24-16-7-3-13(19)4-8-16/h3-10H,2,11-12H2,1H3,(H,20,21)