N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-5-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-pyrazol-1-yl-benzamide

Systemtic Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-5-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-pyrazol-1-yl-benzamide Openeye Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-5-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-pyrazol-1-yl-benzamide CAS Name: N-[[(2R)-7-(3,6-dimethyl-2-pyrazinyl)-5-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-(1-pyrazolyl)benzamide IUPAC Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-pyrazol-1-ylbenzamide Traditional Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-5-fluoro-coumaran-2-yl]methyl]-2-pyrazol-1-yl-benzamide Formula: C25H22FN5O2 MolecularWeight: 443.472883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)C2=CC(=CC3=C2OC(C3)CNC(=O)C4=CC=CC=C4N5C=CC=N5)F)C

Isomeric SMILES

CC1=CN=C(C(=N1)C2=CC(=CC3=C2O[C@H](C3)CNC(=O)C4=CC=CC=C4N5C=CC=N5)F)C

InChI

InChI=1S/C25H22FN5O2/c1-15-13-27-16(2)23(30-15)21-12-18(26)10-17-11-19(33-24(17)21)14-28-25(32)20-6-3-4-7-22(20)31-9-5-8-29-31/h3-10,12-13,19H,11,14H2,1-2H3,(H,28,32)/t19-/m1/s1