1-butyl-3-[(1-phenylpyrazol-4-yl)methyl]urea

Systemtic Name: 1-butyl-3-[(1-phenylpyrazol-4-yl)methyl]urea Openeye Name: 1-butyl-3-[(1-phenylpyrazol-4-yl)methyl]urea CAS Name: 1-butyl-3-[(1-phenyl-4-pyrazolyl)methyl]urea IUPAC Name: 1-butyl-3-[(1-phenylpyrazol-4-yl)methyl]urea Traditional Name: 1-butyl-3-[(1-phenylpyrazol-4-yl)methyl]urea Formula: C15H20N4O MolecularWeight: 272.3455

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)NCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C15H20N4O/c1-2-3-9-16-15(20)17-10-13-11-18-19(12-13)14-7-5-4-6-8-14/h4-8,11-12H,2-3,9-10H2,1H3,(H2,16,17,20)