[2-[2-[(5-cyanopyridin-2-yl)carbamoylamino]cyclopropyl]-6-ethanoyl-3-fluoranyl-phenyl] 6-azanylpyridine-3-carboxylate

Systemtic Name: [2-[2-[(5-cyanopyridin-2-yl)carbamoylamino]cyclopropyl]-6-ethanoyl-3-fluoranyl-phenyl] 6-azanylpyridine-3-carboxylate Openeye Name: [6-acetyl-2-[2-[(5-cyano-2-pyridyl)carbamoylamino]cyclopropyl]-3-fluoro-phenyl] 6-aminopyridine-3-carboxylate CAS Name: 6-amino-3-pyridinecarboxylic acid [6-acetyl-2-[2-[[[(5-cyano-2-pyridinyl)amino]-oxomethyl]amino]cyclopropyl]-3-fluorophenyl] ester IUPAC Name: [6-acetyl-2-[2-[(5-cyanopyridin-2-yl)carbamoylamino]cyclopropyl]-3-fluorophenyl] 6-aminopyridine-3-carboxylate Traditional Name: 6-aminonicotinic acid [6-acetyl-2-[2-[(5-cyano-2-pyridyl)carbamoylamino]cyclopropyl]-3-fluoro-phenyl] ester Formula: C24H19FN6O4 MolecularWeight: 474.443863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1)F)C2CC2NC(=O)NC3=NC=C(C=C3)C#N)OC(=O)C4=CN=C(C=C4)N

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1)F)C2CC2NC(=O)NC3=NC=C(C=C3)C#N)OC(=O)C4=CN=C(C=C4)N

InChI

InChI=1S/C24H19FN6O4/c1-12(32)15-4-5-17(25)21(22(15)35-23(33)14-3-6-19(27)28-11-14)16-8-18(16)30-24(34)31-20-7-2-13(9-26)10-29-20/h2-7,10-11,16,18H,8H2,1H3,(H2,27,28)(H2,29,30,31,34)