N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-7-methyl-2,1,3-benzoselenadiazole-4-sulfonamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-7-methyl-2,1,3-benzoselenadiazole-4-sulfonamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-7-methyl-2,1,3-benzoselenadiazole-4-sulfonamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-7-methyl-2,1,3-benzoselenadiazole-4-sulfonamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-7-methyl-2,1,3-benzoselenadiazole-4-sulfonamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-7-methyl-piaselenole-4-sulfonamide Formula: C18H17N5O3SSe MolecularWeight: 462.38428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=N[Se]N=C12)S(=O)(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C2=N[Se]N=C12)S(=O)(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C18H17N5O3SSe/c1-11-9-10-14(17-15(11)20-28-21-17)27(25,26)19-16-12(2)22(3)23(18(16)24)13-7-5-4-6-8-13/h4-10,19H,1-3H3