[4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butan-2-yl] pyrazine-2-carboxylate

Systemtic Name: [4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-butan-2-yl] pyrazine-2-carboxylate Openeye Name: [3-[4-(4-fluorophenyl)thiazol-2-yl]-1-methyl-2-oxo-propyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [4-[4-(4-fluorophenyl)-2-thiazolyl]-3-oxobutan-2-yl] ester IUPAC Name: [4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-oxobutan-2-yl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [3-[4-(4-fluorophenyl)thiazol-2-yl]-2-keto-1-methyl-propyl] ester Formula: C18H14FN3O3S MolecularWeight: 371.385463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CC1=NC(=CS1)C2=CC=C(C=C2)F)OC(=O)C3=NC=CN=C3

Isomeric SMILES

CC(C(=O)CC1=NC(=CS1)C2=CC=C(C=C2)F)OC(=O)C3=NC=CN=C3

InChI

InChI=1S/C18H14FN3O3S/c1-11(25-18(24)14-9-20-6-7-21-14)16(23)8-17-22-15(10-26-17)12-2-4-13(19)5-3-12/h2-7,9-11H,8H2,1H3