methyl 5-[[(4-fluorophenyl)carbonylamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[(4-fluorophenyl)carbonylamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[(4-fluorobenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[(4-fluorophenyl)-oxomethyl]hydrazo]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[(4-fluorobenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[(4-fluorobenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H16FN3O4 MolecularWeight: 333.314343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NNC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NNC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H16FN3O4/c1-8-12(16(23)24-3)9(2)18-13(8)15(22)20-19-14(21)10-4-6-11(17)7-5-10/h4-7,18H,1-3H3,(H,19,21)(H,20,22)