1-[2,5-bis(fluoranyl)phenyl]-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea

Systemtic Name: 1-[2,5-bis(fluoranyl)phenyl]-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea Openeye Name: 1-(2,5-difluorophenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea CAS Name: 1-(2,5-difluorophenyl)-3-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]urea IUPAC Name: 1-(2,5-difluorophenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methyl]urea Traditional Name: 1-(2,5-difluorophenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea Formula: C22H19F2N5O MolecularWeight: 407.415966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CNC(=O)NC2=C(C=CC(=C2)F)F)N3C=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CNC(=O)NC2=C(C=CC(=C2)F)F)N3C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H19F2N5O/c1-15-18(14-25-22(30)26-20-13-16(23)9-10-19(20)24)21(28-11-5-6-12-28)29(27-15)17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H2,25,26,30)