1-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]urea

Systemtic Name: 1-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]urea Openeye Name: [(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]urea CAS Name: [(E)-(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]urea IUPAC Name: [(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]urea Traditional Name: [(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]urea Formula: C13H15N5O MolecularWeight: 257.2911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N/NC(=O)N

InChI

InChI=1S/C13H15N5O/c1-9-12(8-15-16-13(14)19)10(2)18(17-9)11-6-4-3-5-7-11/h3-8H,1-2H3,(H3,14,16,19)/b15-8+