N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2,1,3-benzoselenadiazole-5-sulfonamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2,1,3-benzoselenadiazole-5-sulfonamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2,1,3-benzoselenadiazole-5-sulfonamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2,1,3-benzoselenadiazole-5-sulfonamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2,1,3-benzoselenadiazole-5-sulfonamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)piaselenole-5-sulfonamide Formula: C17H15N5O3SSe MolecularWeight: 448.3577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=N[Se]N=C4C=C3

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=N[Se]N=C4C=C3

InChI

InChI=1S/C17H15N5O3SSe/c1-11-16(17(23)22(21(11)2)12-6-4-3-5-7-12)18-26(24,25)13-8-9-14-15(10-13)20-27-19-14/h3-10,18H,1-2H3