5-[2-(3-bromanylphenoxy)ethylsulfanyl]-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(3-bromanylphenoxy)ethylsulfanyl]-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[2-(3-bromophenoxy)ethylsulfanyl]-N-(m-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(3-bromophenoxy)ethylthio]-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[2-(3-bromophenoxy)ethylsulfanyl]-N-(3-methylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[2-(3-bromophenoxy)ethylthio]-1,3,4-thiadiazol-2-yl]-(m-tolyl)amine Formula: C17H16BrN3OS2 MolecularWeight: 422.36244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H16BrN3OS2/c1-12-4-2-6-14(10-12)19-16-20-21-17(24-16)23-9-8-22-15-7-3-5-13(18)11-15/h2-7,10-11H,8-9H2,1H3,(H,19,20)