4-(2,2-dimethylpropanoyl)-2-iodanyl-2-methyl-N-phenyl-1,3-dithiane-4-carboxamide

Systemtic Name: 4-(2,2-dimethylpropanoyl)-2-iodanyl-2-methyl-N-phenyl-1,3-dithiane-4-carboxamide Openeye Name: 4-(2,2-dimethylpropanoyl)-2-iodo-2-methyl-N-phenyl-1,3-dithiane-4-carboxamide CAS Name: 4-(2,2-dimethyl-1-oxopropyl)-2-iodo-2-methyl-N-phenyl-1,3-dithiane-4-carboxamide IUPAC Name: 4-(2,2-dimethylpropanoyl)-2-iodo-2-methyl-N-phenyl-1,3-dithiane-4-carboxamide Traditional Name: 2-iodo-2-methyl-N-phenyl-4-pivaloyl-1,3-dithiane-4-carboxamide Formula: C17H22INO2S2 MolecularWeight: 463.39655

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Descriptors Computed from Structure

Canonical SMILES:

CC1(SCCC(S1)(C(=O)C(C)(C)C)C(=O)NC2=CC=CC=C2)I

Isomeric SMILES

CC1(SCCC(S1)(C(=O)C(C)(C)C)C(=O)NC2=CC=CC=C2)I

InChI

InChI=1S/C17H22INO2S2/c1-15(2,3)13(20)17(10-11-22-16(4,18)23-17)14(21)19-12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3,(H,19,21)