N-[[(2R)-5-chloranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[[(2R)-5-chloranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[[(2R)-5-chloro-7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[[(2R)-5-chloro-7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[[(2R)-5-chloro-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[[(2R)-5-chloro-7-(2-pyrimidyl)coumaran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C19H18ClN5O2 MolecularWeight: 383.83152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)NCC2CC3=C(O2)C(=CC(=C3)Cl)C4=NC=CC=N4

Isomeric SMILES

CC1=CC(=NN1C)C(=O)NC[C@H]2CC3=C(O2)C(=CC(=C3)Cl)C4=NC=CC=N4

InChI

InChI=1S/C19H18ClN5O2/c1-11-6-16(24-25(11)2)19(26)23-10-14-8-12-7-13(20)9-15(17(12)27-14)18-21-4-3-5-22-18/h3-7,9,14H,8,10H2,1-2H3,(H,23,26)/t14-/m1/s1