1-heptan-2-yl-3-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-heptan-2-yl-3-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(1-methylhexyl)-3-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-heptan-2-yl-3-[[2-(1-pyrazolylmethyl)phenyl]methyl]urea IUPAC Name: 1-heptan-2-yl-3-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(1-methylhexyl)-3-[2-(pyrazol-1-ylmethyl)benzyl]urea Formula: C19H28N4O MolecularWeight: 328.45182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)NCC1=CC=CC=C1CN2C=CC=N2

Isomeric SMILES

CCCCCC(C)NC(=O)NCC1=CC=CC=C1CN2C=CC=N2

InChI

InChI=1S/C19H28N4O/c1-3-4-5-9-16(2)22-19(24)20-14-17-10-6-7-11-18(17)15-23-13-8-12-21-23/h6-8,10-13,16H,3-5,9,14-15H2,1-2H3,(H2,20,22,24)