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

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-(3,5-dimethyl-1-phenyl-4-pyrazolyl)methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(3,5-dimethyl-1-phenylpyrazol-4-yl)methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methanone Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C25H28N4O2/c1-18-24(19(2)29(26-18)22-6-4-3-5-7-22)25(30)28-13-11-27(12-14-28)17-20-8-9-23-21(16-20)10-15-31-23/h3-9,16H,10-15,17H2,1-2H3