methyl 4-[2-[3-(3-fluoranyl-4-methoxy-phenyl)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[3-(3-fluoranyl-4-methoxy-phenyl)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[3-(3-fluoro-4-methoxy-phenyl)propanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[3-(3-fluoro-4-methoxyphenyl)-1-oxopropyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[3-(3-fluoro-4-methoxyphenyl)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[3-(3-fluoro-4-methoxy-phenyl)propanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C19H18FN3O4S MolecularWeight: 403.427323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC)F

InChI

InChI=1S/C19H18FN3O4S/c1-26-16-5-3-11(7-13(16)20)4-6-17(24)23-19-22-15(10-28-19)12-8-14(21-9-12)18(25)27-2/h3,5,7-10,21H,4,6H2,1-2H3,(H,22,23,24)