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

Systemtic Name: 1-(4-nitrophenyl)-1-(4-oxidanylidene-6-tridecyl-1H-pyrimidin-2-yl)urea Openeye Name: 1-(4-nitrophenyl)-1-(4-oxo-6-tridecyl-1H-pyrimidin-2-yl)urea CAS Name: 1-(4-nitrophenyl)-1-(4-oxo-6-tridecyl-1H-pyrimidin-2-yl)urea IUPAC Name: 1-(4-nitrophenyl)-1-(4-oxo-6-tridecyl-1H-pyrimidin-2-yl)urea Traditional Name: 1-(4-keto-6-tridecyl-1H-pyrimidin-2-yl)-1-(4-nitrophenyl)urea Formula: C24H35N5O4 MolecularWeight: 457.5658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC(=O)N=C(N1)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCC1=CC(=O)N=C(N1)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C24H35N5O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-18-22(30)27-24(26-19)28(23(25)31)20-14-16-21(17-15-20)29(32)33/h14-18H,2-13H2,1H3,(H2,25,31)(H,26,27,30)