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

Systemtic Name: methyl 4-[2-[2-(2-cyanophenoxy)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[2-(2-cyanophenoxy)propanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[2-(2-cyanophenoxy)-1-oxopropyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[2-(2-cyanophenoxy)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[2-(2-cyanophenoxy)propanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)OC)OC3=CC=CC=C3C#N

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)OC)OC3=CC=CC=C3C#N

InChI

InChI=1S/C19H16N4O4S/c1-11(27-16-6-4-3-5-12(16)8-20)17(24)23-19-22-15(10-28-19)13-7-14(21-9-13)18(25)26-2/h3-7,9-11,21H,1-2H3,(H,22,23,24)