N-(2-ethylphenyl)-5-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2-ethylphenyl)-5-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-ethylphenyl)-5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(2-ethylphenyl)-5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2-ethylphenyl)-5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: (2-ethylphenyl)-[5-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C19H18FN3O2S2 MolecularWeight: 403.493523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NN=C(S2)SCC3=C4C(=CC(=C3)F)COCO4

Isomeric SMILES

CCC1=CC=CC=C1NC2=NN=C(S2)SCC3=C4C(=CC(=C3)F)COCO4

InChI

InChI=1S/C19H18FN3O2S2/c1-2-12-5-3-4-6-16(12)21-18-22-23-19(27-18)26-10-14-8-15(20)7-13-9-24-11-25-17(13)14/h3-8H,2,9-11H2,1H3,(H,21,22)