1-butyl-3-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]urea

Systemtic Name: 1-butyl-3-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]urea Openeye Name: 1-butyl-3-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]urea CAS Name: 1-butyl-3-[(3-fluorophenyl)-(1-methyl-2-imidazolyl)methyl]urea IUPAC Name: 1-butyl-3-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]urea Traditional Name: 1-butyl-3-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]urea Formula: C16H21FN4O MolecularWeight: 304.362543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(C1=CC(=CC=C1)F)C2=NC=CN2C

Isomeric SMILES

CCCCNC(=O)NC(C1=CC(=CC=C1)F)C2=NC=CN2C

InChI

InChI=1S/C16H21FN4O/c1-3-4-8-19-16(22)20-14(15-18-9-10-21(15)2)12-6-5-7-13(17)11-12/h5-7,9-11,14H,3-4,8H2,1-2H3,(H2,19,20,22)