N-[2-tert-butyl-5,5-bis(oxidanylidene)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-iodanyl-benzamide

Systemtic Name: N-[2-tert-butyl-5,5-bis(oxidanylidene)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-iodanyl-benzamide Openeye Name: N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-iodo-benzamide CAS Name: N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-iodobenzamide IUPAC Name: N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-iodobenzamide Traditional Name: N-(2-tert-butyl-5,5-diketo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-iodo-benzamide Formula: C16H18IN3O3S MolecularWeight: 459.30189

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C2CS(=O)(=O)CC2=N1)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CC(C)(C)N1C(=C2CS(=O)(=O)CC2=N1)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C16H18IN3O3S/c1-16(2,3)20-14(11-8-24(22,23)9-13(11)19-20)18-15(21)10-6-4-5-7-12(10)17/h4-7H,8-9H2,1-3H3,(H,18,21)