2-[1-(2-iodanyl-3,4-dihydro-1,4-thiazin-2-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(2-iodanyl-3,4-dihydro-1,4-thiazin-2-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-benzyl-2-(2-iodo-3,4-dihydro-1,4-thiazin-2-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-(2-iodo-3,4-dihydro-1,4-thiazin-2-yl)-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(2-iodo-3,4-dihydro-1,4-thiazin-2-yl)-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-benzyl-2-(2-iodo-3,4-dihydro-1,4-thiazin-2-yl)-2-keto-ethyl]isoindoline-1,3-quinone Formula: C21H17IN2O3S MolecularWeight: 504.34075

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC=CN1)(C(=O)C(CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)I

Isomeric SMILES

C1C(SC=CN1)(C(=O)C(CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)I

InChI

InChI=1S/C21H17IN2O3S/c22-21(13-23-10-11-28-21)18(25)17(12-14-6-2-1-3-7-14)24-19(26)15-8-4-5-9-16(15)20(24)27/h1-11,17,23H,12-13H2