N-[[(2R)-7-(3-methylpyridin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[[(2R)-7-(3-methylpyridin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-[[(2R)-7-(3-methyl-2-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-pyrazol-1-yl-benzamide CAS Name: N-[[(2R)-7-(3-methyl-2-pyridinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-[[(2R)-7-(3-methylpyridin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-[[(2R)-7-(3-methyl-2-pyridyl)coumaran-2-yl]methyl]-4-pyrazol-1-yl-benzamide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2=C3C(=CC=C2)CC(O3)CNC(=O)C4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

CC1=C(N=CC=C1)C2=C3C(=CC=C2)C[C@@H](O3)CNC(=O)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C25H22N4O2/c1-17-5-3-12-26-23(17)22-7-2-6-19-15-21(31-24(19)22)16-27-25(30)18-8-10-20(11-9-18)29-14-4-13-28-29/h2-14,21H,15-16H2,1H3,(H,27,30)/t21-/m1/s1