N-[[(2R)-7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-piperidin-1-yl-benzamide

Systemtic Name: N-[[(2R)-7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-piperidin-1-yl-benzamide Openeye Name: N-[[(2R)-7-chloro-5-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]-4-(1-piperidyl)benzamide CAS Name: N-[[(2R)-7-chloro-5-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-(1-piperidinyl)benzamide IUPAC Name: N-[[(2R)-7-chloro-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-piperidin-1-ylbenzamide Traditional Name: N-[[(2R)-7-chloro-5-(5-pyrimidyl)coumaran-2-yl]methyl]-4-piperidino-benzamide Formula: C25H25ClN4O2 MolecularWeight: 448.9446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C(=O)NCC3CC4=C(O3)C(=CC(=C4)C5=CN=CN=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C(=O)NC[C@H]3CC4=C(O3)C(=CC(=C4)C5=CN=CN=C5)Cl

InChI

InChI=1S/C25H25ClN4O2/c26-23-12-18(20-13-27-16-28-14-20)10-19-11-22(32-24(19)23)15-29-25(31)17-4-6-21(7-5-17)30-8-2-1-3-9-30/h4-7,10,12-14,16,22H,1-3,8-9,11,15H2,(H,29,31)/t22-/m1/s1