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

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=CN3)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=CN3)C(=O)C

InChI

InChI=1S/C19H18N2O3S/c1-3-13-4-6-14(7-5-13)18-21-16(11-25-18)10-24-19(23)17-8-15(9-20-17)12(2)22/h4-9,11,20H,3,10H2,1-2H3