(2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-[[2-fluoranyl-3-[(6-methylpyridin-3-yl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: (2-oxidanylidene-2-propan-2-yloxy-ethyl) 4-[[2-fluoranyl-3-[(6-methylpyridin-3-yl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate Openeye Name: (2-isopropoxy-2-oxo-ethyl) 4-[[2-fluoro-3-[(6-methyl-3-pyridyl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[2-fluoro-3-[[[(6-methyl-3-pyridinyl)amino]-oxomethyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid (2-oxo-2-propan-2-yloxyethyl) ester IUPAC Name: (2-oxo-2-propan-2-yloxyethyl) 4-[[2-fluoro-3-[(6-methylpyridin-3-yl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-3-[(6-methyl-3-pyridyl)carbamoylamino]benzyl]piperazine-1-carboxylic acid (2-isopropoxy-2-keto-ethyl) ester Formula: C24H30FN5O5 MolecularWeight: 487.523903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)NC(=O)NC2=CC=CC(=C2F)CN3CCN(CC3)C(=O)OCC(=O)OC(C)C

Isomeric SMILES

CC1=NC=C(C=C1)NC(=O)NC2=CC=CC(=C2F)CN3CCN(CC3)C(=O)OCC(=O)OC(C)C

InChI

InChI=1S/C24H30FN5O5/c1-16(2)35-21(31)15-34-24(33)30-11-9-29(10-12-30)14-18-5-4-6-20(22(18)25)28-23(32)27-19-8-7-17(3)26-13-19/h4-8,13,16H,9-12,14-15H2,1-3H3,(H2,27,28,32)