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

Systemtic Name: N-[[(2R)-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[[(2R)-7-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[[(2R)-7-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[[(2R)-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[[(2R)-7-pyrazin-2-ylcoumaran-2-yl]methyl]-3-(pyrazol-1-ylmethyl)benzamide Formula: C24H21N5O2 MolecularWeight: 411.45584

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C=CC=C21)C3=NC=CN=C3)CNC(=O)C4=CC(=CC=C4)CN5C=CC=N5

Isomeric SMILES

C1[C@@H](OC2=C(C=CC=C21)C3=NC=CN=C3)CNC(=O)C4=CC(=CC=C4)CN5C=CC=N5

InChI

InChI=1S/C24H21N5O2/c30-24(19-6-1-4-17(12-19)16-29-11-3-8-28-29)27-14-20-13-18-5-2-7-21(23(18)31-20)22-15-25-9-10-26-22/h1-12,15,20H,13-14,16H2,(H,27,30)/t20-/m1/s1