N-[[(2R)-5-fluoranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-[[(2R)-5-fluoranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-[[(2R)-5-fluoro-7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-[[(2R)-5-fluoro-7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[[(2R)-5-fluoro-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-[[(2R)-5-fluoro-7-(2-pyrimidyl)coumaran-2-yl]methyl]-3-(3-methylpyrazol-1-yl)propionamide Formula: C20H20FN5O2 MolecularWeight: 381.403503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CCC(=O)NCC2CC3=C(O2)C(=CC(=C3)F)C4=NC=CC=N4

Isomeric SMILES

CC1=NN(C=C1)CCC(=O)NC[C@H]2CC3=C(O2)C(=CC(=C3)F)C4=NC=CC=N4

InChI

InChI=1S/C20H20FN5O2/c1-13-3-7-26(25-13)8-4-18(27)24-12-16-10-14-9-15(21)11-17(19(14)28-16)20-22-5-2-6-23-20/h2-3,5-7,9,11,16H,4,8,10,12H2,1H3,(H,24,27)/t16-/m1/s1