N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(2-fluoranylphenoxy)ethanamide

Systemtic Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(2-fluoranylphenoxy)ethanamide Openeye Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(2-fluorophenoxy)acetamide CAS Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-2-(2-fluorophenoxy)acetamide IUPAC Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-2-(2-fluorophenoxy)acetamide Traditional Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2-(2-fluorophenoxy)acetamide Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)COC4=CC=CC=C4F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)COC4=CC=CC=C4F)C

InChI

InChI=1S/C21H19FN4O2S/c1-12-8-13(2)20-17(9-12)29-21(24-20)26-18(10-14(3)25-26)23-19(27)11-28-16-7-5-4-6-15(16)22/h4-10H,11H2,1-3H3,(H,23,27)