N-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(3-fluorophenyl)-1,2,4-triazin-3-amine

Systemtic Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(3-fluorophenyl)-1,2,4-triazin-3-amine Openeye Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(3-fluorophenyl)-1,2,4-triazin-3-amine CAS Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(3-fluorophenyl)-1,2,4-triazin-3-amine IUPAC Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-5-(3-fluorophenyl)-1,2,4-triazin-3-amine Traditional Name: [5-(3-fluorophenyl)-1,2,4-triazin-3-yl]-(piazthiol-5-ylmethyl)amine Formula: C16H11FN6S MolecularWeight: 338.362143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C2=CN=NC(=N2)NCC3=CC4=NSN=C4C=C3

Isomeric SMILES

C1=CC(=CC(=C1)F)C2=CN=NC(=N2)NCC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C16H11FN6S/c17-12-3-1-2-11(7-12)15-9-19-21-16(20-15)18-8-10-4-5-13-14(6-10)23-24-22-13/h1-7,9H,8H2,(H,18,20,21)