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

Systemtic Name: ethyl 2-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3-fluoroanilino)-oxomethyl]-(3-methoxypropyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(3-fluorophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C18H22FN3O4S MolecularWeight: 395.448383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(CCCOC)C(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(CCCOC)C(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C18H22FN3O4S/c1-3-26-17(23)15-12-27-16(21-15)11-22(8-5-9-25-2)18(24)20-14-7-4-6-13(19)10-14/h4,6-7,10,12H,3,5,8-9,11H2,1-2H3,(H,20,24)