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

Systemtic Name: ethyl 2-[[(3-fluorophenyl)carbonyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(3-fluorobenzoyl)-isopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3-fluorophenyl)-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(3-fluorobenzoyl)-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(3-fluorobenzoyl)-isopropyl-amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C17H19FN2O3S MolecularWeight: 350.407763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C17H19FN2O3S/c1-4-23-17(22)14-10-24-15(19-14)9-20(11(2)3)16(21)12-6-5-7-13(18)8-12/h5-8,10-11H,4,9H2,1-3H3