ethyl 2-[[cyclopropyl-(4-fluorophenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[cyclopropyl-(4-fluorophenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[cyclopropyl-(4-fluorobenzoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclopropyl-[(4-fluorophenyl)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclopropyl-(4-fluorobenzoyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclopropyl-(4-fluorobenzoyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C17H17FN2O3S MolecularWeight: 348.391883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C2CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C2CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN2O3S/c1-2-23-17(22)14-10-24-15(19-14)9-20(13-7-8-13)16(21)11-3-5-12(18)6-4-11/h3-6,10,13H,2,7-9H2,1H3