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

Systemtic Name: 1-(4-ethylphenyl)-3-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-(4-ethylphenyl)-3-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 1-(4-ethylphenyl)-3-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-(4-ethylphenyl)-3-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-(4-ethylphenyl)-3-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]urea Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NCC2=CC=CN2CC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NCC2=CC=CN2CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O/c1-2-16-7-11-19(12-8-16)24-21(26)23-14-20-4-3-13-25(20)15-17-5-9-18(22)10-6-17/h3-13H,2,14-15H2,1H3,(H2,23,24,26)