1-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)methylideneamino]urea

Systemtic Name: 1-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)methylideneamino]urea Openeye Name: [(E)-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methyleneamino]urea CAS Name: [(E)-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methylideneamino]urea IUPAC Name: [(E)-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methylideneamino]urea Traditional Name: [(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)methyleneamino]urea Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C=NNC(=O)N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1/C=N/NC(=O)N)C2=CC=CC=C2

InChI

InChI=1S/C12H13N5O2/c1-8-10(7-14-15-12(13)19)11(18)17(16-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H3,13,15,19)/b14-7+