N-[[(2R)-5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[[(2R)-5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[[(2R)-5-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-4-(trifluoromethyl)benzamide CAS Name: N-[[(2R)-5-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[[(2R)-5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[[(2R)-5-pyrazin-2-ylcoumaran-2-yl]methyl]-4-(trifluoromethyl)benzamide Formula: C21H16F3N3O2 MolecularWeight: 399.36585

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C3=NC=CN=C3)CNC(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1[C@@H](OC2=C1C=C(C=C2)C3=NC=CN=C3)CNC(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H16F3N3O2/c22-21(23,24)16-4-1-13(2-5-16)20(28)27-11-17-10-15-9-14(3-6-19(15)29-17)18-12-25-7-8-26-18/h1-9,12,17H,10-11H2,(H,27,28)/t17-/m1/s1