ethyl 2-(cyclopropylamino)-5-fluoranyl-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylate

Systemtic Name: ethyl 2-(cyclopropylamino)-5-fluoranyl-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylate Openeye Name: ethyl 2-(cyclopropylamino)-5-fluoro-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylate CAS Name: 2-(cyclopropylamino)-5-fluoro-6-(4-methyl-1-piperazinyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(cyclopropylamino)-5-fluoro-6-(4-methylpiperazin-1-yl)pyridine-3-carboxylate Traditional Name: 2-(cyclopropylamino)-5-fluoro-6-(4-methylpiperazino)nicotinic acid ethyl ester Formula: C16H23FN4O2 MolecularWeight: 322.377823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1NC2CC2)N3CCN(CC3)C)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1NC2CC2)N3CCN(CC3)C)F

InChI

InChI=1S/C16H23FN4O2/c1-3-23-16(22)12-10-13(17)15(19-14(12)18-11-4-5-11)21-8-6-20(2)7-9-21/h10-11H,3-9H2,1-2H3,(H,18,19)