4-(furan-2-ylmethyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(furan-2-ylmethyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(2-furylmethyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-(2-furanylmethyl)-1-[(1-methyl-4-pyrazolyl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(furan-2-ylmethyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(2-furfuryl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CC(CN(CC2=O)CC3=CC=CO3)OCC4=CN=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CN2CC(CN(CC2=O)CC3=CC=CO3)OCC4=CN=CC=C4

InChI

InChI=1S/C21H25N5O3/c1-24-10-18(9-23-24)11-26-14-20(29-16-17-4-2-6-22-8-17)13-25(15-21(26)27)12-19-5-3-7-28-19/h2-10,20H,11-16H2,1H3