2-[[4-azanyl-5-[(4-fluoranylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-phenyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(4-fluoranylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-phenyl-ethanamide Openeye Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-phenyl-acetamide CAS Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-ethyl-N-phenylacetamide IUPAC Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-phenylacetamide Traditional Name: 2-[[4-amino-5-[(4-fluorophenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-ethyl-N-phenyl-acetamide Formula: C19H20FN5O2S MolecularWeight: 401.457803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2N)COC3=CC=C(C=C3)F

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2N)COC3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FN5O2S/c1-2-24(15-6-4-3-5-7-15)18(26)13-28-19-23-22-17(25(19)21)12-27-16-10-8-14(20)9-11-16/h3-11H,2,12-13,21H2,1H3