1-[5-[(6-chloranylpyridin-3-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-dimethyl-urea

Systemtic Name: 1-[5-[(6-chloranylpyridin-3-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-dimethyl-urea Openeye Name: 1-[5-[(6-chloro-3-pyridyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-dimethyl-urea CAS Name: 1-[5-[(6-chloro-3-pyridinyl)methylthio]-1,3,4-thiadiazol-2-yl]-1,3-dimethylurea IUPAC Name: 1-[5-[(6-chloropyridin-3-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-dimethylurea Traditional Name: 1-[5-[(6-chloro-3-pyridyl)methylthio]-1,3,4-thiadiazol-2-yl]-1,3-dimethyl-urea Formula: C11H12ClN5OS2 MolecularWeight: 329.82888

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N(C)C1=NN=C(S1)SCC2=CN=C(C=C2)Cl

Isomeric SMILES

CNC(=O)N(C)C1=NN=C(S1)SCC2=CN=C(C=C2)Cl

InChI

InChI=1S/C11H12ClN5OS2/c1-13-9(18)17(2)10-15-16-11(20-10)19-6-7-3-4-8(12)14-5-7/h3-5H,6H2,1-2H3,(H,13,18)