[2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: [2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 4-pyrazol-1-ylbenzoate Openeye Name: [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [2-[(4-fluorophenoxy)methyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl ester Formula: C21H16FN3O3S MolecularWeight: 409.433443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)COC4=CC=C(C=C4)F

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)COC4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O3S/c22-16-4-8-19(9-5-16)27-13-20-24-17(14-29-20)12-28-21(26)15-2-6-18(7-3-15)25-11-1-10-23-25/h1-11,14H,12-13H2