[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-imidazol-1-ylpyridin-4-yl)methanone

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-imidazol-1-ylpyridin-4-yl)methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-(2-imidazol-1-yl-4-pyridyl)methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-[2-(1-imidazolyl)-4-pyridinyl]methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-imidazol-1-ylpyridin-4-yl)methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-(2-imidazol-1-yl-4-pyridyl)methanone Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC(=NC=C4)N5C=CN=C5

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C22H23N5O2/c28-22(19-3-5-24-21(14-19)27-7-6-23-16-27)26-10-8-25(9-11-26)15-17-1-2-20-18(13-17)4-12-29-20/h1-3,5-7,13-14,16H,4,8-12,15H2