1-(4-cyano-2-phenyl-pyrazol-3-yl)-3-(4-nitrophenyl)sulfonyl-urea

Systemtic Name: 1-(4-cyano-2-phenyl-pyrazol-3-yl)-3-(4-nitrophenyl)sulfonyl-urea Openeye Name: 1-(4-cyano-2-phenyl-pyrazol-3-yl)-3-(4-nitrophenyl)sulfonyl-urea CAS Name: 1-(4-cyano-2-phenyl-3-pyrazolyl)-3-(4-nitrophenyl)sulfonylurea IUPAC Name: 1-(4-cyano-2-phenylpyrazol-3-yl)-3-(4-nitrophenyl)sulfonylurea Traditional Name: 1-(4-cyano-2-phenyl-pyrazol-3-yl)-3-nosyl-urea Formula: C17H12N6O5S MolecularWeight: 412.37938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NC(=O)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NC(=O)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N6O5S/c18-10-12-11-19-22(13-4-2-1-3-5-13)16(12)20-17(24)21-29(27,28)15-8-6-14(7-9-15)23(25)26/h1-9,11H,(H2,20,21,24)