5-[(6-chloranylpyridin-3-yl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(6-chloranylpyridin-3-yl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(6-chloro-3-pyridyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(6-chloro-3-pyridinyl)methylthio]-N-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(6-chloropyridin-3-yl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(6-chloro-3-pyridyl)methylthio]-1,3,4-thiadiazol-2-yl]-p-anisyl-amine Formula: C16H15ClN4OS2 MolecularWeight: 378.8995

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NN=C(S2)SCC3=CN=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NN=C(S2)SCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN4OS2/c1-22-13-5-2-11(3-6-13)8-19-15-20-21-16(24-15)23-10-12-4-7-14(17)18-9-12/h2-7,9H,8,10H2,1H3,(H,19,20)