4-(2,3-dimethyl-5-oxidanylidene-4-propan-2-yl-pyrazol-1-yl)-N-(9-oxidanylidenethioxanthen-2-yl)benzenesulfonamide

Systemtic Name: 4-(2,3-dimethyl-5-oxidanylidene-4-propan-2-yl-pyrazol-1-yl)-N-(9-oxidanylidenethioxanthen-2-yl)benzenesulfonamide Openeye Name: 4-(4-isopropyl-2,3-dimethyl-5-oxo-pyrazol-1-yl)-N-(9-oxothioxanthen-2-yl)benzenesulfonamide CAS Name: 4-(2,3-dimethyl-5-oxo-4-propan-2-yl-1-pyrazolyl)-N-(9-oxo-2-thioxanthenyl)benzenesulfonamide IUPAC Name: 4-(2,3-dimethyl-5-oxo-4-propan-2-ylpyrazol-1-yl)-N-(9-oxothioxanthen-2-yl)benzenesulfonamide Traditional Name: 4-(4-isopropyl-5-keto-2,3-dimethyl-3-pyrazolin-1-yl)-N-(9-ketothioxanthen-2-yl)benzenesulfonamide Formula: C27H25N3O4S2 MolecularWeight: 519.6351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)SC5=CC=CC=C5C4=O)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)SC5=CC=CC=C5C4=O)C(C)C

InChI

InChI=1S/C27H25N3O4S2/c1-16(2)25-17(3)29(4)30(27(25)32)19-10-12-20(13-11-19)36(33,34)28-18-9-14-24-22(15-18)26(31)21-7-5-6-8-23(21)35-24/h5-16,28H,1-4H3