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

Systemtic Name: 5-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3,4-dichlorophenyl)methylthio]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3,4-dichlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-(4-methoxyphenyl)amine Formula: C16H13Cl2N3OS2 MolecularWeight: 398.32992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H13Cl2N3OS2/c1-22-12-5-3-11(4-6-12)19-15-20-21-16(24-15)23-9-10-2-7-13(17)14(18)8-10/h2-8H,9H2,1H3,(H,19,20)