[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C15H16FN3O3S MolecularWeight: 337.369243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC(=O)NCC2=CC=C(C=C2)F)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC(=O)NCC2=CC=C(C=C2)F)NC

InChI

InChI=1S/C15H16FN3O3S/c1-9-13(14(17-2)23-19-9)15(21)22-8-12(20)18-7-10-3-5-11(16)6-4-10/h3-6,17H,7-8H2,1-2H3,(H,18,20)