[(2S)-2,3-dihydro-1-benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [(2S)-2,3-dihydro-1-benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [(2S)-2,3-dihydrobenzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [(2S)-2,3-dihydrobenzofuran-2-yl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [(2S)-2,3-dihydro-1-benzofuran-2-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [(2S)-coumaran-2-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)[C@@H]3CC4=CC=CC=C4O3

InChI

InChI=1S/C17H18N4O2/c22-16(15-12-13-4-1-2-5-14(13)23-15)20-8-10-21(11-9-20)17-18-6-3-7-19-17/h1-7,15H,8-12H2/t15-/m0/s1