2-acetyloxyethyl 4-[[2-fluoranyl-3-[(6-methylpyridin-3-yl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: 2-acetyloxyethyl 4-[[2-fluoranyl-3-[(6-methylpyridin-3-yl)carbamoylamino]phenyl]methyl]piperazine-1-carboxylate Openeye Name: 2-acetoxyethyl 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-acetyloxyethyl ester IUPAC Name: 2-acetyloxyethyl 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-acetoxyethyl ester Formula: C23H28FN5O5 MolecularWeight: 473.497323

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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)OCCOC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H28FN5O5/c1-16-6-7-19(14-25-16)26-22(31)27-20-5-3-4-18(21(20)24)15-28-8-10-29(11-9-28)23(32)34-13-12-33-17(2)30/h3-7,14H,8-13,15H2,1-2H3,(H2,26,27,31)