1-butyl-1-(4-oxidanylidene-6-tridecyl-1H-pyrimidin-2-yl)urea

Systemtic Name: 1-butyl-1-(4-oxidanylidene-6-tridecyl-1H-pyrimidin-2-yl)urea Openeye Name: 1-butyl-1-(4-oxo-6-tridecyl-1H-pyrimidin-2-yl)urea CAS Name: 1-butyl-1-(4-oxo-6-tridecyl-1H-pyrimidin-2-yl)urea IUPAC Name: 1-butyl-1-(4-oxo-6-tridecyl-1H-pyrimidin-2-yl)urea Traditional Name: 1-butyl-1-(4-keto-6-tridecyl-1H-pyrimidin-2-yl)urea Formula: C22H40N4O2 MolecularWeight: 392.5786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC(=O)N=C(N1)N(CCCC)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCC1=CC(=O)N=C(N1)N(CCCC)C(=O)N

InChI

InChI=1S/C22H40N4O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-18-20(27)25-22(24-19)26(21(23)28)17-6-4-2/h18H,3-17H2,1-2H3,(H2,23,28)(H,24,25,27)