4-(1-methylsulfanyl-2-phenoxathiin-2-yl-ethylidene)morpholin-4-ium hydroiodide

Systemtic Name: 4-(1-methylsulfanyl-2-phenoxathiin-2-yl-ethylidene)morpholin-4-ium hydroiodide Openeye Name: 4-(1-methylsulfanyl-2-phenoxathiin-2-yl-ethylidene)morpholin-4-ium hydroiodide CAS Name: 4-[1-(methylthio)-2-(2-phenoxathiinyl)ethylidene]morpholin-4-ium hydroiodide IUPAC Name: 4-(1-methylsulfanyl-2-phenoxathiin-2-ylethylidene)morpholin-4-ium hydroiodide Traditional Name: 4-[1-(methylthio)-2-phenoxathiin-2-yl-ethylidene]morpholin-4-ium hydroiodide Formula: C19H21INO2S2+ MolecularWeight: 486.41001

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=[N+]1CCOCC1)CC2=CC3=C(C=C2)OC4=CC=CC=C4S3.I

Isomeric SMILES

CSC(=[N+]1CCOCC1)CC2=CC3=C(C=C2)OC4=CC=CC=C4S3.I

InChI

InChI=1S/C19H20NO2S2.HI/c1-23-19(20-8-10-21-11-9-20)13-14-6-7-16-18(12-14)24-17-5-3-2-4-15(17)22-16;/h2-7,12H,8-11,13H2,1H3;1H/q+1;