1-(4-methyl-3-nitro-phenyl)-3-pyrimidin-2-yl-urea

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-3-pyrimidin-2-yl-urea Openeye Name: 1-(4-methyl-3-nitro-phenyl)-3-pyrimidin-2-yl-urea CAS Name: 1-(4-methyl-3-nitrophenyl)-3-(2-pyrimidinyl)urea IUPAC Name: 1-(4-methyl-3-nitrophenyl)-3-pyrimidin-2-ylurea Traditional Name: 1-(4-methyl-3-nitro-phenyl)-3-(2-pyrimidyl)urea Formula: C12H11N5O3 MolecularWeight: 273.24744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O3/c1-8-3-4-9(7-10(8)17(19)20)15-12(18)16-11-13-5-2-6-14-11/h2-7H,1H3,(H2,13,14,15,16,18)