3-[(2-fluorophenyl)methyl]-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-fluorophenyl)methyl]-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(2-fluorophenyl)methyl]-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(2-fluorophenyl)methyl]-5-[(1-phenyl-4-pyrazolyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-fluorophenyl)methyl]-5-[(1-phenylpyrazol-4-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2-fluorobenzyl)-5-[(1-phenylpyrazol-4-yl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C19H17FN6S MolecularWeight: 380.441883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CSC3=NN=C(N3N)CC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CSC3=NN=C(N3N)CC4=CC=CC=C4F

InChI

InChI=1S/C19H17FN6S/c20-17-9-5-4-6-15(17)10-18-23-24-19(26(18)21)27-13-14-11-22-25(12-14)16-7-2-1-3-8-16/h1-9,11-12H,10,13,21H2