[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methanone

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methanone Formula: C28H27N5O2 MolecularWeight: 465.54628

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CN(N=C4C5=CN=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CN(N=C4C5=CN=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H27N5O2/c34-28(32-14-12-31(13-15-32)19-21-8-9-26-22(17-21)10-16-35-26)25-20-33(24-6-2-1-3-7-24)30-27(25)23-5-4-11-29-18-23/h1-9,11,17-18,20H,10,12-16,19H2