1-(4-ethylphenyl)-3-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]urea

Systemtic Name: 1-(4-ethylphenyl)-3-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]urea Openeye Name: 1-(4-ethylphenyl)-3-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]urea CAS Name: 1-(4-ethylphenyl)-3-[[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methyl]urea IUPAC Name: 1-(4-ethylphenyl)-3-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]urea Traditional Name: 1-(4-ethylphenyl)-3-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]urea Formula: C22H24FN3O MolecularWeight: 365.443863

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NCC2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NCC2=C(N(C(=C2)C)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H24FN3O/c1-4-17-5-9-20(10-6-17)25-22(27)24-14-18-13-15(2)26(16(18)3)21-11-7-19(23)8-12-21/h5-13H,4,14H2,1-3H3,(H2,24,25,27)