3-[bis(azanyl)methylidene]-1-(4-fluoranyl-2-propyl-phenyl)-1-methyl-urea

Systemtic Name: 3-[bis(azanyl)methylidene]-1-(4-fluoranyl-2-propyl-phenyl)-1-methyl-urea Openeye Name: 3-(diaminomethylene)-1-(4-fluoro-2-propyl-phenyl)-1-methyl-urea CAS Name: 3-(diaminomethylidene)-1-(4-fluoro-2-propylphenyl)-1-methylurea IUPAC Name: 3-(diaminomethylidene)-1-(4-fluoro-2-propylphenyl)-1-methylurea Traditional Name: 3-(diaminomethylene)-1-(4-fluoro-2-propyl-phenyl)-1-methyl-urea Formula: C12H17FN4O MolecularWeight: 252.287983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)F)N(C)C(=O)N=C(N)N

Isomeric SMILES

CCCC1=C(C=CC(=C1)F)N(C)C(=O)N=C(N)N

InChI

InChI=1S/C12H17FN4O/c1-3-4-8-7-9(13)5-6-10(8)17(2)12(18)16-11(14)15/h5-7H,3-4H2,1-2H3,(H4,14,15,16,18)