[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=CN3C)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=CN3C)C(=O)C

InChI

InChI=1S/C20H20N2O3S/c1-4-14-5-7-15(8-6-14)19-21-17(12-26-19)11-25-20(24)18-9-16(13(2)23)10-22(18)3/h5-10,12H,4,11H2,1-3H3