ethyl 1-(aminocarbonylamino)-4-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-(aminocarbonylamino)-4-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-(2-fluorophenyl)-2,5-dimethyl-1-ureido-pyrrole-3-carboxylate CAS Name: 1-(carbamoylamino)-4-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(carbamoylamino)-4-(2-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 4-(2-fluorophenyl)-2,5-dimethyl-1-ureido-pyrrole-3-carboxylic acid ethyl ester Formula: C16H18FN3O3 MolecularWeight: 319.330823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=CC=CC=C2F)C)NC(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=CC=C2F)C)NC(=O)N)C

InChI

InChI=1S/C16H18FN3O3/c1-4-23-15(21)14-10(3)20(19-16(18)22)9(2)13(14)11-7-5-6-8-12(11)17/h5-8H,4H2,1-3H3,(H3,18,19,22)