(2-phenyl-1,3-thiazol-4-yl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (2-phenylthiazol-4-yl)methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C18H16N2O3S/c1-12(21)14-8-16(20(2)9-14)18(22)23-10-15-11-24-17(19-15)13-6-4-3-5-7-13/h3-9,11H,10H2,1-2H3