1-(2-methylpropyl)-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)CC2=C(NN=C2)C3=CC=CC=C3)OCC4=CC=NC=C4

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)CC2=C(NN=C2)C3=CC=CC=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C25H31N5O2/c1-19(2)13-30-16-23(32-18-20-8-10-26-11-9-20)15-29(17-24(30)31)14-22-12-27-28-25(22)21-6-4-3-5-7-21/h3-12,19,23H,13-18H2,1-2H3,(H,27,28)