1-(1,3-diphenylpyrazol-4-yl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea

Systemtic Name: 1-(1,3-diphenylpyrazol-4-yl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea Openeye Name: 1-(1,3-diphenylpyrazol-4-yl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]urea CAS Name: 1-(1,3-diphenyl-4-pyrazolyl)-3-[(E)-(5-nitro-2-furanyl)methylideneamino]urea IUPAC Name: 1-(1,3-diphenylpyrazol-4-yl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea Traditional Name: 1-(1,3-diphenylpyrazol-4-yl)-3-[(E)-(5-nitro-2-furyl)methyleneamino]urea Formula: C21H16N6O4 MolecularWeight: 416.38954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2NC(=O)NN=CC3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2NC(=O)N/N=C/C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H16N6O4/c28-21(24-22-13-17-11-12-19(31-17)27(29)30)23-18-14-26(16-9-5-2-6-10-16)25-20(18)15-7-3-1-4-8-15/h1-14H,(H2,23,24,28)/b22-13+