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

Systemtic Name: 1-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]urea CAS Name: 1-[[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]urea Traditional Name: 1-benzyl-3-[[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]urea Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)CNC(=O)NCC3=CC=CC=C3

InChI

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