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

Systemtic Name: 1-(2-methylpropyl)-4-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-4-[(1-methylpyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[(1-methyl-4-pyrazolyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-4-[(1-methylpyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C20H29N5O2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=CN(N=C2)C)OCC3=CC=NC=C3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=CN(N=C2)C)OCC3=CC=NC=C3

InChI

InChI=1S/C20H29N5O2/c1-16(2)9-25-13-19(27-15-17-4-6-21-7-5-17)12-24(14-20(25)26)11-18-8-22-23(3)10-18/h4-8,10,16,19H,9,11-15H2,1-3H3