N-[[(2R)-7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[[(2R)-7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[[(2R)-7-chloro-5-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[[(2R)-7-chloro-5-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[[(2R)-7-chloro-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[[(2R)-7-chloro-5-(5-pyrimidyl)coumaran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide Formula: C24H20ClN5O2 MolecularWeight: 445.9009

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2Cl)C3=CN=CN=C3)CNC(=O)C4=CC(=CC=C4)CN5C=CC=N5

Isomeric SMILES

C1[C@@H](OC2=C1C=C(C=C2Cl)C3=CN=CN=C3)CNC(=O)C4=CC(=CC=C4)CN5C=CC=N5

InChI

InChI=1S/C24H20ClN5O2/c25-22-10-18(20-11-26-15-27-12-20)8-19-9-21(32-23(19)22)13-28-24(31)17-4-1-3-16(7-17)14-30-6-2-5-29-30/h1-8,10-12,15,21H,9,13-14H2,(H,28,31)/t21-/m1/s1