N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-2,3-dihydrobenzofuran-2-yl]methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[[(2R)-7-(3,6-dimethyl-2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[[(2R)-7-(3,6-dimethylpyrazin-2-yl)coumaran-2-yl]methyl]-1-phenyl-pyrazole-4-carboxamide Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)C2=C3C(=CC=C2)CC(O3)CNC(=O)C4=CN(N=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CN=C(C(=N1)C2=C3C(=CC=C2)C[C@@H](O3)CNC(=O)C4=CN(N=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C25H23N5O2/c1-16-12-26-17(2)23(29-16)22-10-6-7-18-11-21(32-24(18)22)14-27-25(31)19-13-28-30(15-19)20-8-4-3-5-9-20/h3-10,12-13,15,21H,11,14H2,1-2H3,(H,27,31)/t21-/m1/s1