methyl 2-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]-1-methyl-3H-pyrrole-2-carboxylate

Systemtic Name: methyl 2-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]-1-methyl-3H-pyrrole-2-carboxylate Openeye Name: methyl 2-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]-1-methyl-3H-pyrrole-2-carboxylate CAS Name: 2-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]-1-methyl-3H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]-1-methyl-3H-pyrrole-2-carboxylate Traditional Name: 2-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]-1-methyl-2-pyrroline-2-carboxylic acid methyl ester Formula: C11H12ClFN4O2 MolecularWeight: 286.689983

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CCC1(C(=O)OC)NC2=NC(=NC=C2F)Cl

Isomeric SMILES

CN1C=CCC1(C(=O)OC)NC2=NC(=NC=C2F)Cl

InChI

InChI=1S/C11H12ClFN4O2/c1-17-5-3-4-11(17,9(18)19-2)16-8-7(13)6-14-10(12)15-8/h3,5-6H,4H2,1-2H3,(H,14,15,16)