N-[3-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenoxy]propyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenoxy]propyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: N-[3-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenoxy]propyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: N-[3-[4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenoxy]propyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: N-[3-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenoxy]propyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: N-[3-[4-[[4-(2-pyrimidyl)piperazino]methyl]phenoxy]propyl]coumaran-2-carboxamide Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)OCCCNC(=O)C3CC4=CC=CC=C4O3)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)OCCCNC(=O)C3CC4=CC=CC=C4O3)C5=NC=CC=N5

InChI

InChI=1S/C27H31N5O3/c33-26(25-19-22-5-1-2-6-24(22)35-25)28-13-4-18-34-23-9-7-21(8-10-23)20-31-14-16-32(17-15-31)27-29-11-3-12-30-27/h1-3,5-12,25H,4,13-20H2,(H,28,33)