3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-[(2-fluoranylphenoxy)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-[(2-fluoranylphenoxy)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-[(2-fluorophenoxy)methyl]-1,2,4-triazol-4-amine CAS Name: 3-(1,3-benzothiazol-2-ylmethylthio)-5-[(2-fluorophenoxy)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-[(2-fluorophenoxy)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-(1,3-benzothiazol-2-ylmethylthio)-5-[(2-fluorophenoxy)methyl]-1,2,4-triazol-4-yl]amine Formula: C17H14FN5OS2 MolecularWeight: 387.454363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CSC3=NN=C(N3N)COC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CSC3=NN=C(N3N)COC4=CC=CC=C4F

InChI

InChI=1S/C17H14FN5OS2/c18-11-5-1-3-7-13(11)24-9-15-21-22-17(23(15)19)25-10-16-20-12-6-2-4-8-14(12)26-16/h1-8H,9-10,19H2