1-butyl-1-(cyanomethyl)-3-(4-methylphenyl)urea

Systemtic Name: 1-butyl-1-(cyanomethyl)-3-(4-methylphenyl)urea Openeye Name: 1-butyl-1-(cyanomethyl)-3-(p-tolyl)urea CAS Name: 1-butyl-1-(cyanomethyl)-3-(4-methylphenyl)urea IUPAC Name: 1-butyl-1-(cyanomethyl)-3-(4-methylphenyl)urea Traditional Name: 1-butyl-1-(cyanomethyl)-3-(p-tolyl)urea Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC#N)C(=O)NC1=CC=C(C=C1)C

Isomeric SMILES

CCCCN(CC#N)C(=O)NC1=CC=C(C=C1)C

InChI

InChI=1S/C14H19N3O/c1-3-4-10-17(11-9-15)14(18)16-13-7-5-12(2)6-8-13/h5-8H,3-4,10-11H2,1-2H3,(H,16,18)