N-[[(2R)-7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[[(2R)-7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2,2-diphenyl-ethanamide Openeye Name: N-[[(2R)-7-chloro-5-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]-2,2-diphenyl-acetamide CAS Name: N-[[(2R)-7-chloro-5-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2,2-diphenylacetamide IUPAC Name: N-[[(2R)-7-chloro-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2,2-diphenylacetamide Traditional Name: N-[[(2R)-7-chloro-5-(5-pyrimidyl)coumaran-2-yl]methyl]-2,2-diphenyl-acetamide Formula: C27H22ClN3O2 MolecularWeight: 455.93548

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2Cl)C3=CN=CN=C3)CNC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H](OC2=C1C=C(C=C2Cl)C3=CN=CN=C3)CNC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22ClN3O2/c28-24-13-20(22-14-29-17-30-15-22)11-21-12-23(33-26(21)24)16-31-27(32)25(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-11,13-15,17,23,25H,12,16H2,(H,31,32)/t23-/m1/s1