3-(3-bromophenyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea

Systemtic Name: 3-(3-bromophenyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-(3-bromophenyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 3-(3-bromophenyl)-1-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-prop-2-enylurea IUPAC Name: 3-(3-bromophenyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea Traditional Name: 1-allyl-3-(3-bromophenyl)-1-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]urea Formula: C22H21BrFN3O MolecularWeight: 442.324043

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

C=CCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H21BrFN3O/c1-2-12-27(22(28)25-20-6-3-5-18(23)14-20)16-21-7-4-13-26(21)15-17-8-10-19(24)11-9-17/h2-11,13-14H,1,12,15-16H2,(H,25,28)