methyl 4-(2-fluorophenyl)-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-fluorophenyl)-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate Openeye Name: methyl 4-(2-fluorophenyl)-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate CAS Name: 1-[[anilino(oxo)methyl]amino]-4-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-fluorophenyl)-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylate Traditional Name: 4-(2-fluorophenyl)-2,5-dimethyl-1-(phenylcarbamoylamino)pyrrole-3-carboxylic acid methyl ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1NC(=O)NC2=CC=CC=C2)C)C(=O)OC)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C(=C(N1NC(=O)NC2=CC=CC=C2)C)C(=O)OC)C3=CC=CC=C3F

InChI

InChI=1S/C21H20FN3O3/c1-13-18(16-11-7-8-12-17(16)22)19(20(26)28-3)14(2)25(13)24-21(27)23-15-9-5-4-6-10-15/h4-12H,1-3H3,(H2,23,24,27)