5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-N-(2-methylphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-N-(2-methylphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-N-(o-tolyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-fluoro-4-methoxyphenyl)methylthio]-N-(2-methylphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-N-(2-methylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-fluoro-4-methoxy-benzyl)thio]-1,3,4-thiadiazol-2-yl]-(o-tolyl)amine Formula: C17H16FN3OS2 MolecularWeight: 361.456843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN=C(S2)SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=CC=CC=C1NC2=NN=C(S2)SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C17H16FN3OS2/c1-11-5-3-4-6-14(11)19-16-20-21-17(24-16)23-10-12-7-8-15(22-2)13(18)9-12/h3-9H,10H2,1-2H3,(H,19,20)